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)	2.27	8.05	-42.37	2	3	1	34	288.39	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.27	7.44	-7.36	1	3	0	30	287.382	4	↓ MOL2 SDF SMILES Flexibase

62038348

Analogs

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Popular Name: (4R)-N-[(1R)-2-(4-fluorophenyl)-1-methyl-ethyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (4R)-N-[(1R)-2-(4-fluorophenyl)-…

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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	8.82	-42.88	2	3	1	34	288.39	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.27	7.96	-6.94	1	3	0	30	287.382	4	↓ MOL2 SDF SMILES Flexibase

62038349

Analogs

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Popular Name: (4S)-N-[(1S)-2-(4-fluorophenyl)-1-methyl-ethyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (4S)-N-[(1S)-2-(4-fluorophenyl)-…

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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	8.82	-42.83	2	3	1	34	288.39	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.27	7.85	-6.95	1	3	0	30	287.382	4	↓ MOL2 SDF SMILES Flexibase

62038350

Analogs

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Popular Name: (4S)-N-[(1R)-2-(4-fluorophenyl)-1-methyl-ethyl]-1-methyl-4,5,6,7-tetrahydroindazol-4-amine (4S)-N-[(1R)-2-(4-fluorophenyl)-…

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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	8.02	-42.24	2	3	1	34	288.39	4	↓ MOL2 SDF SMILES Flexibase
Hi High (pH 8-9.5)	2.27	7.56	-8.76	1	3	0	30	287.382	4	↓ MOL2 SDF SMILES Flexibase

20118818

Analogs

14532914
14532915

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Popular Name: [(5S)-5-(cyclopentylamino)-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone [(5S)-5-(cyclopentylamino)-1-eth…

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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	9.44	-44.75	2	5	1	55	363.551	4	↓ MOL2 SDF SMILES Flexibase

20118820

Analogs

14532914
14532915

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Popular Name: [(5R)-5-(cyclopentylamino)-1-ethyl-4,5,6,7-tetrahydroindazol-3-yl]-thiomorpholino-methanone [(5R)-5-(cyclopentylamino)-1-eth…

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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	9.59	-44.84	2	5	1	55	363.551	4	↓ MOL2 SDF SMILES Flexibase

71506723

Analogs

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Popular Name: 1-ethyl-4,5,6,7-tetrahydroindazole-3-carboxylic 1-ethyl-4,5,6,7-tetrahydroindazo…

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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)	1.75	6.09	-60.25	0	4	-1	58	193.226	2	↓ MOL2 SDF SMILES Flexibase

52860984

Analogs

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Popular Name: 3-(piperazin-1-ylmethyl)-4,5,6,7-tetrahydro-1H-indazole 3-(piperazin-1-ylmethyl)-4,5,6,7…

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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)	0.83	2.48	-39.12	3	4	1	49	221.328	2	↓ MOL2 SDF SMILES Flexibase

71577494

Analogs

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Popular Name: 1-benzyl-4,5,6,7-tetrahydroindazole-3-carboxylic 1-benzyl-4,5,6,7-tetrahydroindaz…

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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)	2.97	8.96	-61.59	0	4	-1	58	255.297	3	↓ MOL2 SDF SMILES Flexibase

11802124

Analogs

34431169

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Popular Name: 1-methyl-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid 1-methyl-4,5,6,7-tetrahydro-1H-i…

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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)	1.37	4.25	-62.05	0	4	-1	58	179.199	1	↓ MOL2 SDF SMILES Flexibase

11802126

Analogs

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Popular Name: 1-(1,1-dioxidotetrahydro-3-thienyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid 1-(1,1-dioxidotetrahydro-3-thien…

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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)	0.89	-4.33	-68.61	0	6	-1	92	283.329	2	↓ MOL2 SDF SMILES Flexibase

11802128

Analogs

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Popular Name: 1-(1,1-dioxidotetrahydro-3-thienyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid 1-(1,1-dioxidotetrahydro-3-thien…

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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)	0.89	-4.33	-68.55	0	6	-1	92	283.329	2	↓ MOL2 SDF SMILES Flexibase

11802131

Analogs

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Popular Name: 1-(m-tolyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(m-tolyl)-4,5,6,7-tetrahydroin…

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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)	3.28	1.18	-64.62	0	4	-1	58	255.297	2	↓ MOL2 SDF SMILES Flexibase

11802133

Analogs

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Popular Name: 1-(4-methylphenyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid 1-(4-methylphenyl)-4,5,6,7-tetra…

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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	1.18	-63.79	0	4	-1	58	255.297	2	↓ MOL2 SDF SMILES Flexibase

11802135

Analogs

22141407
36666900
36984537

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Popular Name: 1-(3-chlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(3-chlorophenyl)-4,5,6,7-tetra…

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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)	3.51	0.72	-64.17	0	4	-1	58	275.715	2	↓ MOL2 SDF SMILES Flexibase

11802138

Analogs

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Popular Name: 1-(4-chlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(4-chlorophenyl)-4,5,6,7-tetra…

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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)	3.33	0.71	-60.11	0	4	-1	58	275.715	2	↓ MOL2 SDF SMILES Flexibase

11802140

Analogs

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Popular Name: 1-(3-methoxyphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(3-methoxyphenyl)-4,5,6,7-tetr…

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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)	2.89	0.88	-67.78	0	5	-1	67	271.296	3	↓ MOL2 SDF SMILES Flexibase

11802142

Analogs

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Popular Name: 1-(4-methoxyphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(4-methoxyphenyl)-4,5,6,7-tetr…

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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	0.88	-62.54	0	5	-1	67	271.296	3	↓ MOL2 SDF SMILES Flexibase

11802144

Analogs

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Popular Name: 1-(3,4-dimethylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(3,4-dimethylphenyl)-4,5,6,7-t…

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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)	3.68	1.47	-63.89	0	4	-1	58	269.324	2	↓ MOL2 SDF SMILES Flexibase

11802146

Analogs

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Popular Name: 1-(3-chloro-4-methyl-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(3-chloro-4-methyl-phenyl)-4,5…

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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)	3.91	1.03	-59.53	0	4	-1	58	289.742	2	↓ MOL2 SDF SMILES Flexibase

11802147

Analogs

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Popular Name: 1-(3,5-dimethylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(3,5-dimethylphenyl)-4,5,6,7-t…

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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)	3.90	1.51	-64.11	0	4	-1	58	269.324	2	↓ MOL2 SDF SMILES Flexibase

11802150

Analogs

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Popular Name: 1-(4-bromophenyl)-4,5,6,7-tetrahydro-1H-indazole-3-carboxylic acid 1-(4-bromophenyl)-4,5,6,7-tetrah…

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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	0.1	-59.87	0	4	-1	58	320.166	2	↓ MOL2 SDF SMILES Flexibase

11802152

Analogs

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Popular Name: 1-(4-ethylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(4-ethylphenyl)-4,5,6,7-tetrah…

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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)	3.56	1.34	-63.44	0	4	-1	58	269.324	3	↓ MOL2 SDF SMILES Flexibase

11802153

Analogs

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Popular Name: 1-(4-tert-butylphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(4-tert-butylphenyl)-4,5,6,7-t…

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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)	4.35	2.01	-62.92	0	4	-1	58	297.378	3	↓ MOL2 SDF SMILES Flexibase

11802155

Analogs

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Popular Name: 1-(3-chloro-4-methoxy-phenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(3-chloro-4-methoxy-phenyl)-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)	3.52	0.78	-59.41	0	5	-1	67	305.741	3	↓ MOL2 SDF SMILES Flexibase

11802157

Analogs

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Popular Name: 1-(4-ethoxyphenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(4-ethoxyphenyl)-4,5,6,7-tetra…

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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	0.89	-62.18	0	5	-1	67	285.323	4	↓ MOL2 SDF SMILES Flexibase

11802159

Analogs

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Popular Name: 1-(3,4-dichlorophenyl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(3,4-dichlorophenyl)-4,5,6,7-t…

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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)	4.14	0.58	-56.38	0	4	-1	58	310.16	2	↓ MOL2 SDF SMILES Flexibase

11802162

Analogs

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Popular Name: 1-(1,3-benzoxazol-2-yl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(1,3-benzoxazol-2-yl)-4,5,6,7-…

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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)	2.99	-0.95	-62.01	0	6	-1	84	282.279	2	↓ MOL2 SDF SMILES Flexibase

11802164

Analogs

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Popular Name: 1-(1,3-benzothiazol-2-yl)-4,5,6,7-tetrahydroindazole-3-carboxylic 1-(1,3-benzothiazol-2-yl)-4,5,6,…

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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)	3.63	-0.51	-60.2	0	5	-1	71	298.347	2	↓ MOL2 SDF SMILES Flexibase

11802166

Analogs

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Popular Name: (5R)-1,5-dimethyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-1,5-dimethyl-4,5,6,7-tetrah…

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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)	1.60	4.86	-62.34	0	4	-1	58	193.226	1	↓ MOL2 SDF SMILES Flexibase

11802168

Analogs

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Popular Name: (5S)-1,5-dimethyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5S)-1,5-dimethyl-4,5,6,7-tetrah…

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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)	1.60	4.86	-62.33	0	4	-1	58	193.226	1	↓ MOL2 SDF SMILES Flexibase

11802169

Analogs

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Popular Name: (5R)-1-[(3R)-1,1-dioxothiolan-3-yl]-5-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-1-[(3R)-1,1-dioxothiolan-3-…

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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)	1.12	-3.96	-68.92	0	6	-1	92	297.356	2	↓ MOL2 SDF SMILES Flexibase

11802171

Analogs

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Popular Name: (5S)-1-[(3R)-1,1-dioxothiolan-3-yl]-5-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5S)-1-[(3R)-1,1-dioxothiolan-3-…

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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)	1.12	-3.96	-68.86	0	6	-1	92	297.356	2	↓ MOL2 SDF SMILES Flexibase

11802173

Analogs

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Popular Name: (5R)-1-[(3S)-1,1-dioxothiolan-3-yl]-5-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-1-[(3S)-1,1-dioxothiolan-3-…

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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)	1.12	-3.94	-72.4	0	6	-1	92	297.356	2	↓ MOL2 SDF SMILES Flexibase

11802175

Analogs

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Popular Name: (5S)-1-[(3S)-1,1-dioxothiolan-3-yl]-5-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5S)-1-[(3S)-1,1-dioxothiolan-3-…

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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)	1.12	-3.97	-68.84	0	6	-1	92	297.356	2	↓ MOL2 SDF SMILES Flexibase

11802178

Analogs

41027337
41027338
41027339
41027340

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-5-methyl-1-phenyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-5-methyl-1-phenyl-4,5,6,7-t…

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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)	2.88	1.23	-64.46	0	4	-1	58	255.297	2	↓ MOL2 SDF SMILES Flexibase

11802179

Analogs

41027337
41027338
41027339
41027340

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-5-methyl-1-phenyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5S)-5-methyl-1-phenyl-4,5,6,7-t…

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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)	2.88	1.23	-64.73	0	4	-1	58	255.297	2	↓ MOL2 SDF SMILES Flexibase

11802180

Analogs

41027323
41027324

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Popular Name: (5R)-5-methyl-1-(m-tolyl)-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-5-methyl-1-(m-tolyl)-4,5,6,…

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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)	3.51	1.55	-64.86	0	4	-1	58	269.324	2	↓ MOL2 SDF SMILES Flexibase

11802182

Analogs

41027323
41027324

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-5-methyl-1-(m-tolyl)-4,5,6,7-tetrahydroindazole-3-carboxylic (5S)-5-methyl-1-(m-tolyl)-4,5,6,…

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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)	3.51	1.55	-65.16	0	4	-1	58	269.324	2	↓ MOL2 SDF SMILES Flexibase

11802183

Analogs

41027283
41027284

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-5-methyl-1-(p-tolyl)-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-5-methyl-1-(p-tolyl)-4,5,6,…

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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	1.55	-64.01	0	4	-1	58	269.324	2	↓ MOL2 SDF SMILES Flexibase

11802185

Analogs

41027283
41027284

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-5-methyl-1-(p-tolyl)-4,5,6,7-tetrahydroindazole-3-carboxylic (5S)-5-methyl-1-(p-tolyl)-4,5,6,…

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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	1.55	-64.3	0	4	-1	58	269.324	2	↓ MOL2 SDF SMILES Flexibase

11802187

Analogs

41027297
41027298
41027397
41027398

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-1-(3-chlorophenyl)-5-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-1-(3-chlorophenyl)-5-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)	3.74	1.08	-64.38	0	4	-1	58	289.742	2	↓ MOL2 SDF SMILES Flexibase

11802190

Analogs

41027297
41027298
41027397
41027398

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-1-(3-chlorophenyl)-5-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5S)-1-(3-chlorophenyl)-5-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)	3.74	1.08	-59.74	0	4	-1	58	289.742	2	↓ MOL2 SDF SMILES Flexibase

11802191

Analogs

41027313
41027314

Draw Identity 99% 90% 80% 70%

Popular Name: (5R)-1-(4-chlorophenyl)-5-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5R)-1-(4-chlorophenyl)-5-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)	3.55	1.08	-60.37	0	4	-1	58	289.742	2	↓ MOL2 SDF SMILES Flexibase

11802194

Analogs

41027313
41027314

Draw Identity 99% 90% 80% 70%

Popular Name: (5S)-1-(4-chlorophenyl)-5-methyl-4,5,6,7-tetrahydroindazole-3-carboxylic (5S)-1-(4-chlorophenyl)-5-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)	3.55	1.08	-60.62	0	4	-1	58	289.742	2	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

ring.id = 1685
filter.purchasability = annotated
page.format = targets
page.num = 1

Structural Results Found: (before additional filtering)

SQL Query Was

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<div id="zinc-link"></div>
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