ZINC 12

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.50	5.37	-12.7	1	6	0	85	314.37	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.96	3.4	-45.6	0	6	-1	88	313.362	4	↓ MOL2 SDF SMILES Flexibase

65321339

Analogs

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Popular Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-(2-hydroxyethyl)-6-methyl-pyrimidin-4-o 2-[[3-(3-bromophenyl)-1,2,4-oxad…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.34	3.26	-14.76	2	7	0	105	423.292	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.80	1.34	-45.62	1	7	-1	108	422.284	6	↓ MOL2 SDF SMILES Flexibase

65330904

Analogs

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Popular Name: 6-methyl-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyrimidin-4-ol 6-methyl-2-[(3-phenyl-1,2,4-oxad…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.08	4.71	-12.72	1	6	0	85	300.343	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.54	2.72	-45.65	0	6	-1	88	299.335	4	↓ MOL2 SDF SMILES Flexibase

65330906

Analogs

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Popular Name: 6-methyl-2-[[3-(3,4,5-trimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 6-methyl-2-[[3-(3,4,5-trimethoxy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.71	3.87	-15.29	1	9	0	112	390.421	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.17	1.89	-45.45	0	9	-1	115	389.413	7	↓ MOL2 SDF SMILES Flexibase

65330907

Analogs

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Popular Name: 2-[[3-(4-fluorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-pyrimidin-4-ol 2-[[3-(4-fluorophenyl)-1,2,4-oxa…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.24	4.77	-11.87	1	6	0	85	318.333	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.70	2.79	-43.23	0	6	-1	88	317.325	4	↓ MOL2 SDF SMILES Flexibase

65330911

Analogs

12415011

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Popular Name: 5-(2-hydroxyethyl)-6-methyl-2-[(3-phenyl-1,2,4-oxadiazol-5-yl)methylsulfanyl]pyrimidin-4-ol 5-(2-hydroxyethyl)-6-methyl-2-[(…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.55	2.65	-14.63	2	7	0	105	344.396	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.01	0.72	-47.15	1	7	-1	108	343.388	6	↓ MOL2 SDF SMILES Flexibase

65330913

Analogs

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Popular Name: 5-(2-hydroxyethyl)-2-[[3-(4-isopropoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-pyrimidi 5-(2-hydroxyethyl)-2-[[3-(4-isop…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.35	3.5	-14.68	2	8	0	114	402.476	8	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.81	1.58	-46.22	1	8	-1	117	401.468	8	↓ MOL2 SDF SMILES Flexibase

65330914

Analogs

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Popular Name: 2-[[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-(2-hydroxyethyl)-6-methyl-pyrimidin-4- 2-[[3-(4-chlorophenyl)-1,2,4-oxa…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.23	3.17	-13.52	2	7	0	105	378.841	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.69	1.24	-44.46	1	7	-1	108	377.833	6	↓ MOL2 SDF SMILES Flexibase

65330915

Analogs

12415011

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Popular Name: 5-(2-hydroxyethyl)-6-methyl-2-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 5-(2-hydroxyethyl)-6-methyl-2-[[…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	2.98	3.37	-14.61	2	7	0	105	358.423	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.44	1.43	-47.15	1	7	-1	108	357.415	6	↓ MOL2 SDF SMILES Flexibase

65330916

Analogs

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Popular Name: 2-[[3-(4-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-propyl-pyrimidin-4-ol 2-[[3-(4-bromophenyl)-1,2,4-oxad…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.96	6.83	-10.85	1	6	0	85	407.293	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.42	4.91	-42.82	0	6	-1	88	406.285	6	↓ MOL2 SDF SMILES Flexibase

65330917

Analogs

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Popular Name: 2-[[3-(4-methylsulfanylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-propyl-pyrimidin-4-ol 2-[[3-(4-methylsulfanylphenyl)-1…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.59	7.25	-11.87	1	6	0	85	374.491	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.04	5.32	-44.78	0	6	-1	88	373.483	7	↓ MOL2 SDF SMILES Flexibase

65330918

Analogs

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Popular Name: 2-[[3-(3,4-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(3,4-dimethoxyphenyl)-1,2,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.10	4.52	-15.12	1	8	0	103	374.422	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.56	2.56	-46.93	0	8	-1	106	373.414	6	↓ MOL2 SDF SMILES Flexibase

65330919

Analogs

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Popular Name: 5,6-dimethyl-2-[[3-(m-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 5,6-dimethyl-2-[[3-(m-tolyl)-1,2…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.88	5.97	-12.77	1	6	0	85	328.397	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.34	4.01	-46.24	0	6	-1	88	327.389	4	↓ MOL2 SDF SMILES Flexibase

65330920

Analogs

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Popular Name: 2-[[3-(2-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(2-ethoxyphenyl)-1,2,4-oxa…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.84	5.82	-15.27	1	7	0	94	358.423	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.30	3.86	-50	0	7	-1	97	357.415	6	↓ MOL2 SDF SMILES Flexibase

65330921

Analogs

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Popular Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(3-bromophenyl)-1,2,4-oxad…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.24	5.9	-12.67	1	6	0	85	393.266	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.70	3.96	-44.82	0	6	-1	88	392.258	4	↓ MOL2 SDF SMILES Flexibase

65330922

Analogs

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Popular Name: 2-[[3-(2-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(2-methoxyphenyl)-1,2,4-ox…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.46	4.88	-15.27	1	7	0	94	344.396	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.92	2.93	-49.96	0	7	-1	97	343.388	5	↓ MOL2 SDF SMILES Flexibase

65330923

Analogs

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Popular Name: 2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(3-methoxyphenyl)-1,2,4-ox…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.49	4.59	-14.44	1	7	0	94	344.396	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.94	2.64	-47.38	0	7	-1	97	343.388	5	↓ MOL2 SDF SMILES Flexibase

65330924

Analogs

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Popular Name: 2-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-ethyl-pyrimidin-4-ol 2-[[3-(2-chlorophenyl)-1,2,4-oxa…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.28	6.09	-13.66	1	6	0	85	348.815	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.74	4.19	-47.07	0	6	-1	88	347.807	5	↓ MOL2 SDF SMILES Flexibase

65330925

Analogs

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Popular Name: 2-[[3-(2,3-dimethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-ethyl-pyrimidin-4-ol 2-[[3-(2,3-dimethoxyphenyl)-1,2,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.47	5.06	-16.04	1	8	0	103	374.422	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.93	3.13	-49.23	0	8	-1	106	373.414	7	↓ MOL2 SDF SMILES Flexibase

65330926

Analogs

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Popular Name: 6-ethyl-2-[[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 6-ethyl-2-[[3-[3-(trifluoromethy…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.52	6.44	-13.25	1	6	0	85	382.367	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.98	4.53	-44.66	0	6	-1	88	381.359	6	↓ MOL2 SDF SMILES Flexibase

65330927

Analogs

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Popular Name: 2-[[3-(2-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-ethyl-6-methyl-pyrimidin-4-ol 2-[[3-(2-chlorophenyl)-1,2,4-oxa…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.55	6.66	-14.17	1	6	0	85	362.842	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.01	4.76	-48.15	0	6	-1	88	361.834	5	↓ MOL2 SDF SMILES Flexibase

65330928

Analogs

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Popular Name: 5-ethyl-2-[[3-(4-isopropoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-pyrimidin-4-ol 5-ethyl-2-[[3-(4-isopropoxypheny…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.72	6.85	-12.84	1	7	0	94	386.477	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.17	4.95	-45.84	0	7	-1	97	385.469	7	↓ MOL2 SDF SMILES Flexibase

65330929

Analogs

8599148

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Popular Name: 5-ethyl-6-methyl-2-[[3-(p-tolyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 5-ethyl-6-methyl-2-[[3-(p-tolyl)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.37	6.67	-12.57	1	6	0	85	342.424	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.83	4.76	-46.5	0	6	-1	88	341.416	5	↓ MOL2 SDF SMILES Flexibase

65330930

Analogs

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Popular Name: 2-[[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-ethyl-6-methyl-pyrimidin-4-ol 2-[[3-(3-chlorophenyl)-1,2,4-oxa…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.57	6.5	-12.87	1	6	0	85	362.842	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.03	4.6	-45.33	0	6	-1	88	361.834	5	↓ MOL2 SDF SMILES Flexibase

65330931

Analogs

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Popular Name: 5-ethyl-6-methyl-2-[[3-[3-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-o 5-ethyl-6-methyl-2-[[3-[3-(trifl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.79	7	-13.79	1	6	0	85	396.394	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.25	5.09	-45.7	0	6	-1	88	395.386	6	↓ MOL2 SDF SMILES Flexibase

65330932

Analogs

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Popular Name: 5-ethyl-6-methyl-2-[[3-[4-(trifluoromethyl)phenyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-o 5-ethyl-6-methyl-2-[[3-[4-(trifl…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.82	7	-12.18	1	6	0	85	396.394	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.27	5.09	-43.95	0	6	-1	88	395.386	6	↓ MOL2 SDF SMILES Flexibase

65330933

Analogs

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Popular Name: 2-[[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-ethyl-6-methyl-pyrimidin-4-ol 2-[[3-(3-bromophenyl)-1,2,4-oxad…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.70	6.61	-12.8	1	6	0	85	407.293	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.16	4.71	-45.24	0	6	-1	88	406.285	5	↓ MOL2 SDF SMILES Flexibase

65330934

Analogs

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Popular Name: 5-ethyl-2-[[3-(3-methoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-pyrimidin-4-ol 5-ethyl-2-[[3-(3-methoxyphenyl)-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.95	5.29	-14.55	1	7	0	94	358.423	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.41	3.39	-47.84	0	7	-1	97	357.415	6	↓ MOL2 SDF SMILES Flexibase

65330987

Analogs

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Popular Name: 6-methyl-2-[[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 6-methyl-2-[[3-[4-(trifluorometh…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.05	4.51	-11.9	1	7	0	94	384.339	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.50	2.53	-42.87	0	7	-1	97	383.331	6	↓ MOL2 SDF SMILES Flexibase

65330988

Analogs

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Popular Name: 2-[[3-(3-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-methyl-pyrimidin-4-ol 2-[[3-(3-ethoxyphenyl)-1,2,4-oxa…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.49	4.93	-14.33	1	7	0	94	344.396	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.94	2.96	-46.65	0	7	-1	97	343.388	6	↓ MOL2 SDF SMILES Flexibase

65330989

Analogs

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Popular Name: 6-ethyl-2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 6-ethyl-2-[[3-(4-ethylphenyl)-1,…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.57	6.87	-11.8	1	6	0	85	342.424	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.02	4.95	-45.07	0	6	-1	88	341.416	6	↓ MOL2 SDF SMILES Flexibase

65330990

Analogs

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Popular Name: 6-ethyl-2-[[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 6-ethyl-2-[[3-[4-(trifluorometho…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.62	5.25	-11.48	1	7	0	94	398.366	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.08	3.33	-42.86	0	7	-1	97	397.358	7	↓ MOL2 SDF SMILES Flexibase

65330991

Analogs

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Popular Name: 2-[[3-(4-chloro-3-fluoro-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-ethyl-pyrimidin-4-ol 2-[[3-(4-chloro-3-fluoro-phenyl)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.42	6	-12.17	1	6	0	85	366.805	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.88	4.08	-42.55	0	6	-1	88	365.797	5	↓ MOL2 SDF SMILES Flexibase

65330992

Analogs

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Popular Name: 2-[[3-(3-ethoxyphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-ethyl-pyrimidin-4-ol 2-[[3-(3-ethoxyphenyl)-1,2,4-oxa…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.06	5.65	-13.94	1	7	0	94	358.423	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.52	3.75	-46.68	0	7	-1	97	357.415	7	↓ MOL2 SDF SMILES Flexibase

65330993

Analogs

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Popular Name: 2-[[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-propyl-pyrimidin-4-ol 2-[[3-(3,4-dimethylphenyl)-1,2,4…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.98	7.41	-11.98	1	6	0	85	356.451	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.43	5.5	-45.62	0	6	-1	88	355.443	6	↓ MOL2 SDF SMILES Flexibase

65330994

Analogs

12415580

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Popular Name: 2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-propyl-pyrimidin-4-ol 2-[[3-(4-ethylphenyl)-1,2,4-oxad…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.07	7.66	-11.57	1	6	0	85	356.451	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.53	5.74	-44.99	0	6	-1	88	355.443	7	↓ MOL2 SDF SMILES Flexibase

65330995

Analogs

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Popular Name: 2-[[3-(3-bromo-4-fluoro-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-propyl-pyrimidin-4-ol 2-[[3-(3-bromo-4-fluoro-phenyl)-…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.05	6.88	-11.95	1	6	0	85	425.283	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.51	4.94	-42.42	0	6	-1	88	424.275	6	↓ MOL2 SDF SMILES Flexibase

65330996

Analogs

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Popular Name: 2-[[3-(4-chloro-3-fluoro-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-propyl-pyrimidin-4-ol 2-[[3-(4-chloro-3-fluoro-phenyl)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.92	6.78	-11.98	1	6	0	85	380.832	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.38	4.86	-42.38	0	6	-1	88	379.824	6	↓ MOL2 SDF SMILES Flexibase

65330997

Analogs

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Popular Name: 2-[[3-(3-chloro-4-fluoro-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-6-propyl-pyrimidin-4-ol 2-[[3-(3-chloro-4-fluoro-phenyl)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.92	6.78	-11.91	1	6	0	85	380.832	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.38	4.85	-42.43	0	6	-1	88	379.824	6	↓ MOL2 SDF SMILES Flexibase

65330998

Analogs

12415011

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Popular Name: 2-[[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-(2-hydroxyethyl)-6-methyl-pyrimidi 2-[[3-(3,4-dimethylphenyl)-1,2,4…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.38	3.92	-14.59	2	7	0	105	372.45	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.84	1.97	-47.26	1	7	-1	108	371.442	6	↓ MOL2 SDF SMILES Flexibase

65330999

Analogs

12415011

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Popular Name: 2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-(2-hydroxyethyl)-6-methyl-pyrimidin-4-o 2-[[3-(4-ethylphenyl)-1,2,4-oxad…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.47	4.13	-14.18	2	7	0	105	372.45	7	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.92	2.19	-46.55	1	7	-1	108	371.442	7	↓ MOL2 SDF SMILES Flexibase

65331000

Analogs

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Popular Name: 5-(2-hydroxyethyl)-6-methyl-2-[[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]p 5-(2-hydroxyethyl)-6-methyl-2-[[…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.52	2.45	-13.9	2	8	0	114	428.392	8	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.98	0.53	-44.28	1	8	-1	117	427.384	8	↓ MOL2 SDF SMILES Flexibase

65331001

Analogs

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Popular Name: 2-[[3-(4-chloro-3-fluoro-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5-(2-hydroxyethyl)-6-methyl-py 2-[[3-(4-chloro-3-fluoro-phenyl)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	3.32	3.22	-14.61	2	7	0	105	396.831	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	3.78	1.29	-43.88	1	7	-1	108	395.823	6	↓ MOL2 SDF SMILES Flexibase

65331004

Analogs

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Popular Name: 2-[[3-(3,4-dimethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(3,4-dimethylphenyl)-1,2,4…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.28	6.52	-12.75	1	6	0	85	342.424	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.74	4.56	-46.25	0	6	-1	88	341.416	4	↓ MOL2 SDF SMILES Flexibase

65331005

Analogs

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Popular Name: 2-[[3-(4-ethylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(4-ethylphenyl)-1,2,4-oxad…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.37	6.74	-12.24	1	6	0	85	342.424	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.83	4.77	-45.63	0	6	-1	88	341.416	5	↓ MOL2 SDF SMILES Flexibase

65331006

Analogs

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Popular Name: 5,6-dimethyl-2-[[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]methylsulfanyl]pyrimidin-4-ol 5,6-dimethyl-2-[[3-[4-(trifluoro…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.42	5.1	-11.85	1	7	0	94	398.366	6	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.88	3.13	-43.36	0	7	-1	97	397.358	6	↓ MOL2 SDF SMILES Flexibase

65331007

Analogs

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Popular Name: 2-[[3-(4-chloro-3-fluoro-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(4-chloro-3-fluoro-phenyl)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.22	5.86	-12.53	1	6	0	85	366.805	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.68	3.91	-43.05	0	6	-1	88	365.797	4	↓ MOL2 SDF SMILES Flexibase

65331008

Analogs

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Popular Name: 2-[[3-(3-chloro-4-fluoro-phenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(3-chloro-4-fluoro-phenyl)…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	4.22	5.85	-12.47	1	6	0	85	366.805	4	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	4.68	3.9	-43.06	0	6	-1	88	365.797	4	↓ MOL2 SDF SMILES Flexibase

65331009

Analogs

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Popular Name: 2-[[3-(4-tert-butylphenyl)-1,2,4-oxadiazol-5-yl]methylsulfanyl]-5,6-dimethyl-pyrimidin-4-ol 2-[[3-(4-tert-butylphenyl)-1,2,4…

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Physical Representations

Type pH range	xlogP	Des A‑Pol Apolar desolvation (kcal/mol)	Des Pol Polar desolvation (kcal/mol)	H Don H-bond donors	H Acc H-bond acceptors	Chg Net charge	tPSA (Å²)	MWT Molecular weight (g/mol)	RB Rotatable bonds	DL
Ref Reference (pH 7)	5.16	7.61	-11.89	1	6	0	85	370.478	5	↓ MOL2 SDF SMILES Flexibase
Mid Mid (pH 6-8)	5.62	5.66	-45.22	0	6	-1	88	369.47	5	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

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<script type="text/javascript" src="//zinc12.docking.org/js/embed.js"></script>
<script type="text/javascript">
    window.zinc.embed('zinc-link', {
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