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ZINC Item

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52878785

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-[(4-methylthiadiazole-5-carbonyl)amino]-2-phenyl-propanoic (2S)-2-[(4-methylthiadiazole-5-c…

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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)	1.46	5.66	-49.98	1	6	-1	95	290.324	4	↓ MOL2 SDF SMILES Flexibase

52878788

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-[(4-methylthiadiazole-5-carbonyl)amino]-2-phenyl-propanoic (2R)-2-[(4-methylthiadiazole-5-c…

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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)	1.46	5.65	-49.81	1	6	-1	95	290.324	4	↓ MOL2 SDF SMILES Flexibase

52879066

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2R)-2-phenyl-2-(thiadiazole-5-carbonylamino)propanoic (2R)-2-phenyl-2-(thiadiazole-5-c…

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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)	1.24	5.15	-50.63	1	6	-1	95	276.297	4	↓ MOL2 SDF SMILES Flexibase

52879068

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: (2S)-2-phenyl-2-(thiadiazole-5-carbonylamino)propanoic (2S)-2-phenyl-2-(thiadiazole-5-c…

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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)	1.24	5.15	-50.59	1	6	-1	95	276.297	4	↓ MOL2 SDF SMILES Flexibase

52899047

Analogs

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Popular Name: N-[[4-(2-aminoethyl)phenyl]methyl]-4-methyl-thiadiazole-5-carboxamide N-[[4-(2-aminoethyl)phenyl]methy…

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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)	0.57	2.61	-51.87	4	5	1	83	277.373	5	↓ MOL2 SDF SMILES Flexibase

52899078

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[4-(2-aminoethyl)phenyl]methyl]thiadiazole-5-carboxamide N-[[4-(2-aminoethyl)phenyl]methy…

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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)	0.34	2.02	-51.88	4	5	1	83	263.346	5	↓ MOL2 SDF SMILES Flexibase

22689598

Analogs

7960913

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-N-[(2-fluorophenyl)methyl]thiadiazole-5-carboxamide 4-ethyl-N-[(2-fluorophenyl)methy…

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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)	2.27	4.55	-8.27	1	4	0	55	265.313	4	↓ MOL2 SDF SMILES Flexibase

22690932

Analogs

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Popular Name: N-[(1R)-1-(3,4-dipropoxyphenyl)ethyl]-4-ethyl-thiadiazole-5-carboxamide N-[(1R)-1-(3,4-dipropoxyphenyl)e…

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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)	4.12	8.02	-11.11	1	6	0	73	377.51	10	↓ MOL2 SDF SMILES Flexibase

22690935

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(3,4-dipropoxyphenyl)ethyl]-4-ethyl-thiadiazole-5-carboxamide N-[(1S)-1-(3,4-dipropoxyphenyl)e…

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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)	4.12	8.02	-11.11	1	6	0	73	377.51	10	↓ MOL2 SDF SMILES Flexibase

22699586

Analogs

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Popular Name: N-[(1R)-1-(4-ethoxyphenyl)ethyl]-4-ethyl-thiadiazole-5-carboxamide N-[(1R)-1-(4-ethoxyphenyl)ethyl]…

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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)	3.15	5.6	-9.08	1	5	0	64	305.403	6	↓ MOL2 SDF SMILES Flexibase

22699587

Analogs

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Popular Name: N-[(1S)-1-(4-ethoxyphenyl)ethyl]-4-ethyl-thiadiazole-5-carboxamide N-[(1S)-1-(4-ethoxyphenyl)ethyl]…

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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)	3.15	5.6	-9.07	1	5	0	64	305.403	6	↓ MOL2 SDF SMILES Flexibase

22699603

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-N-[(4-fluoro-3-methyl-phenyl)methyl]thiadiazole-5-carboxamide 4-ethyl-N-[(4-fluoro-3-methyl-ph…

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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)	2.70	5.23	-8.34	1	4	0	55	279.34	4	↓ MOL2 SDF SMILES Flexibase

22702447

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-N-[[4-(2,2,2-trifluoroethoxy)phenyl]methyl]thiadiazole-5-carboxamide 4-ethyl-N-[[4-(2,2,2-trifluoroet…

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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)	3.14	5.21	-10.61	1	5	0	64	345.346	7	↓ MOL2 SDF SMILES Flexibase

54703035

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-N-[[4-[[isopropyl(methyl)amino]methyl]phenyl]methyl]thiadiazole-5-carboxamide 4-ethyl-N-[[4-[[isopropyl(methyl…

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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)	2.63	7.61	-40.73	2	5	1	59	333.481	7	↓ MOL2 SDF SMILES Flexibase

56723976

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-isopentyloxy-3-methoxy-phenyl)methyl]thiadiazole-5-carboxamide N-[(4-isopentyloxy-3-methoxy-phe…

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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)	2.66	5.42	-9.96	1	6	0	73	335.429	8	↓ MOL2 SDF SMILES Flexibase

56892537

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-1-(4-isopentyloxy-3-methoxy-phenyl)ethyl]thiadiazole-5-carboxamide N-[(1R)-1-(4-isopentyloxy-3-meth…

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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)	3.22	6.26	-10.58	1	6	0	73	349.456	8	↓ MOL2 SDF SMILES Flexibase

56892538

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-1-(4-isopentyloxy-3-methoxy-phenyl)ethyl]thiadiazole-5-carboxamide N-[(1S)-1-(4-isopentyloxy-3-meth…

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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)	3.22	6.26	-10.55	1	6	0	73	349.456	8	↓ MOL2 SDF SMILES Flexibase

58333052

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-N-[(3-methoxy-4-methylsulfanyl-phenyl)methyl]-N-methyl-thiadiazole-5-carboxamide 4-ethyl-N-[(3-methoxy-4-methylsu…

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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)	2.82	6.58	-11.91	0	5	0	55	337.47	6	↓ MOL2 SDF SMILES Flexibase

62998623

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1R)-2-hydroxy-1-phenyl-ethyl]-4-methyl-thiadiazole-5-carboxamide N-[(1R)-2-hydroxy-1-phenyl-ethyl…

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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)	1.13	1.47	-6.92	2	5	0	75	263.322	4	↓ MOL2 SDF SMILES Flexibase

62998624

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(1S)-2-hydroxy-1-phenyl-ethyl]-4-methyl-thiadiazole-5-carboxamide N-[(1S)-2-hydroxy-1-phenyl-ethyl…

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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)	1.13	1.48	-6.88	2	5	0	75	263.322	4	↓ MOL2 SDF SMILES Flexibase

63000523

Analogs

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Popular Name: N-[(1S)-2-hydroxy-1-phenyl-ethyl]thiadiazole-5-carboxamide N-[(1S)-2-hydroxy-1-phenyl-ethyl…

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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)	0.91	0.88	-7.39	2	5	0	75	249.295	4	↓ MOL2 SDF SMILES Flexibase

63000524

Analogs

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Popular Name: N-[(1R)-2-hydroxy-1-phenyl-ethyl]thiadiazole-5-carboxamide N-[(1R)-2-hydroxy-1-phenyl-ethyl…

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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)	0.91	0.88	-7.4	2	5	0	75	249.295	4	↓ MOL2 SDF SMILES Flexibase

69563776

Analogs

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Popular Name: 4-ethyl-N-[(4-methoxy-3,5-dimethyl-phenyl)methyl]-N-methyl-thiadiazole-5-carboxamide 4-ethyl-N-[(4-methoxy-3,5-dimeth…

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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)	3.21	7.11	-10.11	0	5	0	55	319.43	5	↓ MOL2 SDF SMILES Flexibase

69566528

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[[3-(tert-butoxymethyl)phenyl]methyl]-4-ethyl-thiadiazole-5-carboxamide N-[[3-(tert-butoxymethyl)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)	3.27	6.33	-6.63	1	5	0	64	333.457	7	↓ MOL2 SDF SMILES Flexibase

69696475

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: N-[(4-bromo-3-fluoro-phenyl)methyl]-4-ethyl-thiadiazole-5-carboxamide N-[(4-bromo-3-fluoro-phenyl)meth…

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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)	3.06	5.17	-7.99	1	4	0	55	344.209	4	↓ MOL2 SDF SMILES Flexibase

69776895

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-ethyl-N-[[4-[ethyl(methyl)amino]-3-fluoro-phenyl]methyl]thiadiazole-5-carboxamide 4-ethyl-N-[[4-[ethyl(methyl)amin…

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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)	2.73	6.37	-7.48	1	5	0	58	322.409	6	↓ MOL2 SDF SMILES Flexibase

69817294

Analogs

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Popular Name: N-[[3-(2,2-difluoroethoxy)phenyl]methyl]-4-ethyl-thiadiazole-5-carboxamide N-[[3-(2,2-difluoroethoxy)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)	2.76	5.05	-11.45	1	5	0	64	327.356	7	↓ MOL2 SDF SMILES Flexibase

48782199

Analogs

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Popular Name: methyl methyl

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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)	1.07	1.42	-11.34	2	7	0	93	292.32	5	↓ MOL2 SDF SMILES Flexibase

48790716

Analogs

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Popular Name: N-[[4-(isopropoxymethyl)phenyl]methyl]thiadiazole-5-carboxamide N-[[4-(isopropoxymethyl)phenyl]m…

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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)	2.05	4.65	-7.56	1	5	0	64	291.376	6	↓ MOL2 SDF SMILES Flexibase

48792721

Analogs

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Popular Name: N-[(4-propoxyphenyl)methyl]thiadiazole-5-carboxamide N-[(4-propoxyphenyl)methyl]thiad…

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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)	2.30	4.22	-7.72	1	5	0	64	277.349	6	↓ MOL2 SDF SMILES Flexibase

48793506

Analogs

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Popular Name: N-[(1S)-1-(3,4-dimethoxyphenyl)ethyl]thiadiazole-5-carboxamide N-[(1S)-1-(3,4-dimethoxyphenyl)e…

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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)	1.57	3.23	-11.12	1	6	0	73	293.348	5	↓ MOL2 SDF SMILES Flexibase

48793508

Analogs

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Popular Name: N-[(1R)-1-(3,4-dimethoxyphenyl)ethyl]thiadiazole-5-carboxamide N-[(1R)-1-(3,4-dimethoxyphenyl)e…

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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)	1.57	3.24	-11.11	1	6	0	73	293.348	5	↓ MOL2 SDF SMILES Flexibase

48794323

Analogs

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Popular Name: N-[[3-(2-methoxyethoxy)phenyl]methyl]thiadiazole-5-carboxamide N-[[3-(2-methoxyethoxy)phenyl]me…

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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)	1.28	2.69	-9.74	1	6	0	73	293.348	7	↓ MOL2 SDF SMILES Flexibase

48794438

Analogs

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Popular Name: N-[(1S)-1-(5-fluoro-2-methoxy-phenyl)ethyl]thiadiazole-5-carboxamide N-[(1S)-1-(5-fluoro-2-methoxy-ph…

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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)	2.07	3.51	-8.36	1	5	0	64	281.312	4	↓ MOL2 SDF SMILES Flexibase

48794440

Analogs

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Popular Name: N-[(1R)-1-(5-fluoro-2-methoxy-phenyl)ethyl]thiadiazole-5-carboxamide N-[(1R)-1-(5-fluoro-2-methoxy-ph…

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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)	2.07	3.5	-8.28	1	5	0	64	281.312	4	↓ MOL2 SDF SMILES Flexibase

48795446

Analogs

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Popular Name: N-[[2-(propoxymethyl)phenyl]methyl]thiadiazole-5-carboxamide N-[[2-(propoxymethyl)phenyl]meth…

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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)	2.15	4.83	-7.06	1	5	0	64	291.376	7	↓ MOL2 SDF SMILES Flexibase

48795929

Analogs

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Popular Name: N-[(3-isopropoxyphenyl)methyl]thiadiazole-5-carboxamide N-[(3-isopropoxyphenyl)methyl]th…

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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)	2.13	4.05	-7.87	1	5	0	64	277.349	5	↓ MOL2 SDF SMILES Flexibase

48940423

Analogs

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Popular Name: N-(2-amino-2-oxo-ethyl)-N-[(4-bromophenyl)methyl]thiadiazole-5-carboxamide N-(2-amino-2-oxo-ethyl)-N-[(4-br…

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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)	1.15	2.69	-15.51	2	6	0	89	355.217	5	↓ MOL2 SDF SMILES Flexibase

48943602

Analogs

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Popular Name: N-[(2-cyanophenyl)methyl]-N-ethyl-thiadiazole-5-carboxamide N-[(2-cyanophenyl)methyl]-N-ethy…

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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)	1.69	6.64	-11.52	0	5	0	70	272.333	4	↓ MOL2 SDF SMILES Flexibase

48948708

Analogs

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Popular Name: N-[(1S)-1-(3-chloro-4-fluoro-phenyl)ethyl]thiadiazole-5-carboxamide N-[(1S)-1-(3-chloro-4-fluoro-phe…

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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)	2.69	4.6	-9.35	1	4	0	55	285.731	3	↓ MOL2 SDF SMILES Flexibase

48948710

Analogs

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Popular Name: N-[(1R)-1-(3-chloro-4-fluoro-phenyl)ethyl]thiadiazole-5-carboxamide N-[(1R)-1-(3-chloro-4-fluoro-phe…

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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)	2.69	4.6	-9.35	1	4	0	55	285.731	3	↓ MOL2 SDF SMILES Flexibase

48948857

Analogs

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Popular Name: N-[(4-methylsulfanylphenyl)methyl]thiadiazole-5-carboxamide N-[(4-methylsulfanylphenyl)methy…

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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)	1.80	4.22	-7.83	1	4	0	55	265.363	4	↓ MOL2 SDF SMILES Flexibase

48952146

Analogs

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Popular Name: N-benzyl-N-(cyanomethyl)thiadiazole-5-carboxamide N-benzyl-N-(cyanomethyl)thiadiaz…

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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)	1.39	5.4	-12.53	0	5	0	70	258.306	4	↓ MOL2 SDF SMILES Flexibase

48953085

Analogs

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Popular Name: N-[(3-isobutoxyphenyl)methyl]thiadiazole-5-carboxamide N-[(3-isobutoxyphenyl)methyl]thi…

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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)	2.52	4.92	-7.54	1	5	0	64	291.376	6	↓ MOL2 SDF SMILES Flexibase

48974614

Analogs

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Popular Name: N-[(1S)-1-[2-(trifluoromethyl)phenyl]ethyl]thiadiazole-5-carboxamide N-[(1S)-1-[2-(trifluoromethyl)ph…

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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)	2.77	5.26	-9.35	1	4	0	55	301.293	4	↓ MOL2 SDF SMILES Flexibase

48974616

Analogs

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Popular Name: N-[(1R)-1-[2-(trifluoromethyl)phenyl]ethyl]thiadiazole-5-carboxamide N-[(1R)-1-[2-(trifluoromethyl)ph…

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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)	2.77	4.71	-9.81	1	4	0	55	301.293	4	↓ MOL2 SDF SMILES Flexibase

49248011

Analogs

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Popular Name: N-[(1R)-1-(3,4-dichlorophenyl)ethyl]thiadiazole-5-carboxamide N-[(1R)-1-(3,4-dichlorophenyl)et…

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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)	3.20	5.01	-8.68	1	4	0	55	302.186	3	↓ MOL2 SDF SMILES Flexibase

49248889

Analogs

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Popular Name: 4-ethyl-N-[(3-hydroxyphenyl)methyl]thiadiazole-5-carboxamide 4-ethyl-N-[(3-hydroxyphenyl)meth…

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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)	1.65	1.65	-7.95	2	5	0	75	263.322	4	↓ MOL2 SDF SMILES Flexibase

49249392

Analogs

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Popular Name: N-ethyl-N-[(3-nitrophenyl)methyl]thiadiazole-5-carboxamide N-ethyl-N-[(3-nitrophenyl)methyl…

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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)	1.92	6.48	-18.96	0	7	0	92	292.32	5	↓ MOL2 SDF SMILES Flexibase

49249395

Analogs

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Popular Name: N-ethyl-N-[(2-nitrophenyl)methyl]thiadiazole-5-carboxamide N-ethyl-N-[(2-nitrophenyl)methyl…

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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)	1.89	6.85	-12.78	0	7	0	92	292.32	5	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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Structural Results Found: (before additional filtering)

SQL Query Was

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