ZINC 12

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ZINC Item

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49338349

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 4-bromo-1-[(3-isopropyl-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)	2.39	5.07	-16.29	0	6	0	78	350.172	3	↓ MOL2 SDF SMILES Flexibase

49338352

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-bromo-1-[(3-isopropyl-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)	2.42	5.08	-13.53	0	6	0	78	350.172	3	↓ MOL2 SDF SMILES Flexibase

49338355

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-chloro-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-chloro-1-[(3-isopropyl-1,2,4-o…

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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)	2.28	4.97	-13.66	0	6	0	78	305.721	3	↓ MOL2 SDF SMILES Flexibase

49338358

Analogs

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Popular Name: 1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]-5-methyl-indoline-2,3-dione 1-[(3-isopropyl-1,2,4-oxadiazol-…

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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)	2.06	5.14	-13.59	0	6	0	78	285.303	3	↓ MOL2 SDF SMILES Flexibase

49338361

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-fluoro-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-fluoro-1-[(3-isopropyl-1,2,4-o…

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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)	1.77	4.53	-12.49	0	6	0	78	289.266	3	↓ MOL2 SDF SMILES Flexibase

49338364

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-bromo-1-[(3-isopropyl-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)	2.42	5.08	-11.99	0	6	0	78	350.172	3	↓ MOL2 SDF SMILES Flexibase

49338367

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]-7-methyl-indoline-2,3-dione 1-[(3-isopropyl-1,2,4-oxadiazol-…

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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)	2.03	4.78	-13.44	0	6	0	78	285.303	3	↓ MOL2 SDF SMILES Flexibase

49338370

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-chloro-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-chloro-1-[(3-isopropyl-1,2,4-o…

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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)	2.28	4.97	-12.21	0	6	0	78	305.721	3	↓ MOL2 SDF SMILES Flexibase

49338373

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-bromo-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-bromo-1-[(3-isopropyl-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)	2.39	5.35	-12.24	0	6	0	78	350.172	3	↓ MOL2 SDF SMILES Flexibase

49338377

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-chloro-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-chloro-1-[(3-isopropyl-1,2,4-o…

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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)	2.26	5.14	-12.49	0	6	0	78	305.721	3	↓ MOL2 SDF SMILES Flexibase

49338380

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-1-[(3-isopropyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 4-chloro-1-[(3-isopropyl-1,2,4-o…

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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)	2.26	4.97	-16.52	0	6	0	78	305.721	3	↓ MOL2 SDF SMILES Flexibase

49338932

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-bromo-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 4-bromo-1-[(3-propyl-1,2,4-oxadi…

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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)	2.41	5.4	-16.19	0	6	0	78	350.172	4	↓ MOL2 SDF SMILES Flexibase

49338934

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-bromo-1-[(3-propyl-1,2,4-oxadi…

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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)	2.43	5.41	-13.43	0	6	0	78	350.172	4	↓ MOL2 SDF SMILES Flexibase

49338937

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-chloro-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-chloro-1-[(3-propyl-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)	2.30	5.29	-13.58	0	6	0	78	305.721	4	↓ MOL2 SDF SMILES Flexibase

49338941

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-methyl-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-methyl-1-[(3-propyl-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)	2.07	5.45	-14.24	0	6	0	78	285.303	4	↓ MOL2 SDF SMILES Flexibase

49338944

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-fluoro-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-fluoro-1-[(3-propyl-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)	1.79	4.86	-12.39	0	6	0	78	289.266	4	↓ MOL2 SDF SMILES Flexibase

49338947

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-bromo-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-bromo-1-[(3-propyl-1,2,4-oxadi…

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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)	2.43	5.4	-11.91	0	6	0	78	350.172	4	↓ MOL2 SDF SMILES Flexibase

49338950

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-methyl-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-methyl-1-[(3-propyl-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)	2.05	5.11	-13.34	0	6	0	78	285.303	4	↓ MOL2 SDF SMILES Flexibase

49338952

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6-chloro-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-chloro-1-[(3-propyl-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)	2.30	5.3	-12.1	0	6	0	78	305.721	4	↓ MOL2 SDF SMILES Flexibase

49338954

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-bromo-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-bromo-1-[(3-propyl-1,2,4-oxadi…

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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)	2.41	5.68	-12.07	0	6	0	78	350.172	4	↓ MOL2 SDF SMILES Flexibase

49338958

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 7-chloro-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-chloro-1-[(3-propyl-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)	2.28	5.46	-12.34	0	6	0	78	305.721	4	↓ MOL2 SDF SMILES Flexibase

49338961

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4-chloro-1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 4-chloro-1-[(3-propyl-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)	2.28	5.29	-16.39	0	6	0	78	305.721	4	↓ MOL2 SDF SMILES Flexibase

42074628

Analogs

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Popular Name: 1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-5,7-dimethyl-indoline-2,3-dione 1-[(3-ethyl-1,2,4-oxadiazol-5-yl…

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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)	1.95	4.99	-13	0	6	0	78	285.303	3	↓ MOL2 SDF SMILES Flexibase

42074730

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5,7-dimethyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5,7-dimethyl-1-[(3-methyl-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)	1.38	4.99	-14.05	0	6	0	78	271.276	2	↓ MOL2 SDF SMILES Flexibase

42076404

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-6,7-dimethyl-indoline-2,3-dione 1-[(3-ethyl-1,2,4-oxadiazol-5-yl…

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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)	1.95	4.87	-13.09	0	6	0	78	285.303	3	↓ MOL2 SDF SMILES Flexibase

42076530

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 6,7-dimethyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6,7-dimethyl-1-[(3-methyl-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)	1.38	4.24	-12.72	0	6	0	78	271.276	2	↓ MOL2 SDF SMILES Flexibase

42076781

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-6-methoxy-indoline-2,3-dione 1-[(3-ethyl-1,2,4-oxadiazol-5-yl…

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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)	1.18	3.33	-14.09	0	7	0	87	287.275	4	↓ MOL2 SDF SMILES Flexibase

42076915

Analogs

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Popular Name: 6-methoxy-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-methoxy-1-[(3-methyl-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)	0.61	2.71	-14.35	0	7	0	87	273.248	3	↓ MOL2 SDF SMILES Flexibase

42077205

Analogs

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Popular Name: 6-chloro-1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-chloro-1-[(3-ethyl-1,2,4-oxadi…

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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	4.52	-12.38	0	6	0	78	291.694	3	↓ MOL2 SDF SMILES Flexibase

42077360

Analogs

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Popular Name: 6-chloro-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 6-chloro-1-[(3-methyl-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)	1.23	3.91	-12.68	0	6	0	78	277.667	2	↓ MOL2 SDF SMILES Flexibase

42079171

Analogs

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Popular Name: 7-bromo-5-fluoro-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-bromo-5-fluoro-1-[(3-methyl-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)	0.48	4.35	-10.14	0	6	0	78	340.108	2	↓ MOL2 SDF SMILES Flexibase

42079196

Analogs

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Popular Name: 7-bromo-1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-5-fluoro-indoline-2,3-dione 7-bromo-1-[(3-ethyl-1,2,4-oxadia…

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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)	1.05	4.97	-9.85	0	6	0	78	354.135	3	↓ MOL2 SDF SMILES Flexibase

42100499

Analogs

20254208

Draw Identity 99% 90% 80% 70%

Popular Name: 7-bromo-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-bromo-1-[(3-methyl-1,2,4-oxadi…

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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)	1.34	4.28	-12.66	0	6	0	78	322.118	2	↓ MOL2 SDF SMILES Flexibase

42100505

Analogs

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Popular Name: 7-bromo-1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-bromo-1-[(3-ethyl-1,2,4-oxadia…

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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)	1.91	4.91	-12.41	0	6	0	78	336.145	3	↓ MOL2 SDF SMILES Flexibase

42101195

Analogs

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Popular Name: 4,6-dimethyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 4,6-dimethyl-1-[(3-methyl-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)	1.38	4.7	-13.66	0	6	0	78	271.276	2	↓ MOL2 SDF SMILES Flexibase

42101211

Analogs

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Popular Name: 1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-4,6-dimethyl-indoline-2,3-dione 1-[(3-ethyl-1,2,4-oxadiazol-5-yl…

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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)	1.95	5.33	-14.25	0	6	0	78	285.303	3	↓ MOL2 SDF SMILES Flexibase

42102721

Analogs

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Popular Name: 5-methoxy-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-methoxy-1-[(3-methyl-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)	0.61	2.69	-15.76	0	7	0	87	273.248	3	↓ MOL2 SDF SMILES Flexibase

42102742

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-5-methoxy-indoline-2,3-dione 1-[(3-ethyl-1,2,4-oxadiazol-5-yl…

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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)	1.18	3.31	-15.52	0	7	0	87	287.275	4	↓ MOL2 SDF SMILES Flexibase

42105334

Analogs

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Popular Name: 5-ethyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-ethyl-1-[(3-methyl-1,2,4-oxadi…

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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	4.83	-13.82	0	6	0	78	271.276	3	↓ MOL2 SDF SMILES Flexibase

42105364

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-ethyl-1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-ethyl-1-[(3-ethyl-1,2,4-oxadia…

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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)	2.04	5.46	-13.46	0	6	0	78	285.303	4	↓ MOL2 SDF SMILES Flexibase

42108204

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 4,7-dimethyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 4,7-dimethyl-1-[(3-methyl-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)	1.38	4.97	-14.57	0	6	0	78	271.276	2	↓ MOL2 SDF SMILES Flexibase

42108230

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-4,7-dimethyl-indoline-2,3-dione 1-[(3-ethyl-1,2,4-oxadiazol-5-yl…

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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)	1.95	4.99	-13.54	0	6	0	78	285.303	3	↓ MOL2 SDF SMILES Flexibase

42111430

Analogs

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Popular Name: 7-chloro-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-chloro-1-[(3-methyl-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)	1.20	4.07	-12.92	0	6	0	78	277.667	2	↓ MOL2 SDF SMILES Flexibase

42111456

Analogs

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Popular Name: 7-chloro-1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-chloro-1-[(3-ethyl-1,2,4-oxadi…

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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)	1.78	4.69	-12.62	0	6	0	78	291.694	3	↓ MOL2 SDF SMILES Flexibase

42114178

Analogs

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Popular Name: 5,7-difluoro-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5,7-difluoro-1-[(3-methyl-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)	-0.17	3.44	-11.17	0	6	0	78	279.202	2	↓ MOL2 SDF SMILES Flexibase

42114204

Analogs

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Popular Name: 1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-5,7-difluoro-indoline-2,3-dione 1-[(3-ethyl-1,2,4-oxadiazol-5-yl…

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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)	0.40	4.06	-10.91	0	6	0	78	293.229	3	↓ MOL2 SDF SMILES Flexibase

42116614

Analogs

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Popular Name: 7-fluoro-5-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 7-fluoro-5-methyl-1-[(3-methyl-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)	1.09	4.03	-11.85	0	6	0	78	275.239	2	↓ MOL2 SDF SMILES Flexibase

42116641

Analogs

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Popular Name: 1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-7-fluoro-5-methyl-indoline-2,3-dione 1-[(3-ethyl-1,2,4-oxadiazol-5-yl…

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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)	1.66	4.65	-12.33	0	6	0	78	289.266	3	↓ MOL2 SDF SMILES Flexibase

42118019

Analogs

20254208

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-7-methyl-1-[(3-methyl-1,2,4-oxadiazol-5-yl)methyl]indoline-2,3-dione 5-bromo-7-methyl-1-[(3-methyl-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)	1.74	4.32	-12.1	0	6	0	78	336.145	2	↓ MOL2 SDF SMILES Flexibase

42118037

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 5-bromo-1-[(3-ethyl-1,2,4-oxadiazol-5-yl)methyl]-7-methyl-indoline-2,3-dione 5-bromo-1-[(3-ethyl-1,2,4-oxadia…

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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)	2.31	4.94	-11.94	0	6	0	78	350.172	3	↓ MOL2 SDF SMILES Flexibase

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SQL Query Was

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