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20121328

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-[1-(1,1-dimethylpropyl)tetrazol-5-yl]butyl]-(2-furylmethyl)amino]methyl]-7-methoxy-1H-qu 3-[[[(1R)-1-[1-(1,1-dimethylprop…

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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)	3.77	8.35	-18.59	1	9	0	102	478.597	11	↓ MOL2 SDF SMILES Flexibase

20121330

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1S)-1-[1-(1,1-dimethylpropyl)tetrazol-5-yl]butyl]-(2-furylmethyl)amino]methyl]-7-methoxy-1H-qu 3-[[[(1S)-1-[1-(1,1-dimethylprop…

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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)	3.77	7.7	-12.59	1	9	0	102	478.597	11	↓ MOL2 SDF SMILES Flexibase

1373598

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[(1-tert-butyltetrazol-5-yl)methyl-(2-furfuryl)amino]methyl]-6,7-dimethoxy-carbostyril 3-[[(1-tert-butyltetrazol-5-yl)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)	1.24	6.04	-14.95	1	10	0	111	452.515	9	↓ MOL2 SDF SMILES Flexibase

1373668

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[5-[[2-furfuryl-[(2-keto-6,7-dimethoxy-1H-quinolin-3-yl)methyl]amino]methyl]tetrazol-1-yl]acetic-a 2-[5-[[2-furfuryl-[(2-keto-6,7-d…

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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)	0.29	6.03	-17.56	1	12	0	138	482.497	12	↓ MOL2 SDF SMILES Flexibase

1374048

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[5-[(1S)-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl-(2-furfuryl)amino]propyl]tetrazol-1-yl]acetic- 2-[5-[(1S)-1-[(6-ethyl-2-keto-1H…

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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)	2.62	9.48	-18.62	1	10	0	119	478.553	12	↓ MOL2 SDF SMILES Flexibase

1374050

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[5-[(1R)-1-[(6-ethyl-2-keto-1H-quinolin-3-yl)methyl-(2-furfuryl)amino]propyl]tetrazol-1-yl]acetic- 2-[5-[(1R)-1-[(6-ethyl-2-keto-1H…

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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)	2.62	9.25	-29.4	1	10	0	119	478.553	12	↓ MOL2 SDF SMILES Flexibase

1374102

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1S)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-7-methyl-carbostyril 3-[[[(1S)-1-(1-tert-butyltetrazo…

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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	8.07	-19.7	1	8	0	93	434.544	8	↓ MOL2 SDF SMILES Flexibase

1374103

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-7-methyl-carbostyril 3-[[[(1R)-1-(1-tert-butyltetrazo…

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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	7.77	-20.04	1	8	0	93	434.544	8	↓ MOL2 SDF SMILES Flexibase

1374127

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1S)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-7-methyl-carbostyril 3-[[[(1S)-1-(1-tert-amyltetrazol…

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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)	3.61	8.57	-19.62	1	8	0	93	448.571	9	↓ MOL2 SDF SMILES Flexibase

1374128

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-7-methyl-carbostyril 3-[[[(1R)-1-(1-tert-amyltetrazol…

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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)	3.61	8.27	-20.04	1	8	0	93	448.571	9	↓ MOL2 SDF SMILES Flexibase

1374235

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[5-[(1S)-1-[2-furfuryl-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]amino]propyl]tetrazol-1-yl]acetic 2-[5-[(1S)-1-[2-furfuryl-[(2-ket…

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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)	2.16	8.79	-22.85	1	10	0	119	464.526	11	↓ MOL2 SDF SMILES Flexibase

1374236

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[5-[(1R)-1-[2-furfuryl-[(2-keto-7-methyl-1H-quinolin-3-yl)methyl]amino]propyl]tetrazol-1-yl]acetic 2-[5-[(1R)-1-[2-furfuryl-[(2-ket…

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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)	2.16	9.86	-15.35	1	10	0	119	464.526	11	↓ MOL2 SDF SMILES Flexibase

1374362

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1S)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-6-methoxy-carbostyril 3-[[[(1S)-1-(1-tert-butyltetrazo…

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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	6.68	-19.99	1	9	0	102	450.543	9	↓ MOL2 SDF SMILES Flexibase

1374363

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-6-methoxy-carbostyril 3-[[[(1R)-1-(1-tert-butyltetrazo…

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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	7.06	-17.5	1	9	0	102	450.543	9	↓ MOL2 SDF SMILES Flexibase

1374390

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1S)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-6-methoxy-carbostyril 3-[[[(1S)-1-(1-tert-amyltetrazol…

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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	7.17	-19.85	1	9	0	102	464.57	10	↓ MOL2 SDF SMILES Flexibase

1374391

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-6-methoxy-carbostyril 3-[[[(1R)-1-(1-tert-amyltetrazol…

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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	7.55	-17.36	1	9	0	102	464.57	10	↓ MOL2 SDF SMILES Flexibase

1374473

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[5-[(1S)-1-[2-furfuryl-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]amino]propyl]tetrazol-1-yl]aceti 2-[5-[(1S)-1-[2-furfuryl-[(2-ket…

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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)	1.76	7.41	-22	1	11	0	128	480.525	12	↓ MOL2 SDF SMILES Flexibase

1374474

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 2-[5-[(1R)-1-[2-furfuryl-[(2-keto-6-methoxy-1H-quinolin-3-yl)methyl]amino]propyl]tetrazol-1-yl]aceti 2-[5-[(1R)-1-[2-furfuryl-[(2-ket…

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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)	1.76	7.45	-22.66	1	11	0	128	480.525	12	↓ MOL2 SDF SMILES Flexibase

1375013

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1S)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-6,7-dimethyl-carbostyril 3-[[[(1S)-1-(1-tert-butyltetrazo…

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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)	3.48	8.6	-19.79	1	8	0	93	448.571	8	↓ MOL2 SDF SMILES Flexibase

1375041

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1S)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-6,7-dimethyl-carbostyril 3-[[[(1S)-1-(1-tert-amyltetrazol…

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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)	3.98	8.83	-11.93	1	8	0	93	462.598	9	↓ MOL2 SDF SMILES Flexibase

1375042

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-6,7-dimethyl-carbostyril 3-[[[(1R)-1-(1-tert-amyltetrazol…

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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)	3.98	9.47	-17.28	1	8	0	93	462.598	9	↓ MOL2 SDF SMILES Flexibase

1375213

Analogs

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Popular Name: 3-[[[(1S)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-5,7-dimethyl-carbostyril 3-[[[(1S)-1-(1-tert-butyltetrazo…

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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)	3.78	8.37	-11.99	1	8	0	93	448.571	8	↓ MOL2 SDF SMILES Flexibase

1375214

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-5,7-dimethyl-carbostyril 3-[[[(1R)-1-(1-tert-butyltetrazo…

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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)	3.78	8.97	-17.22	1	8	0	93	448.571	8	↓ MOL2 SDF SMILES Flexibase

1375234

Analogs

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Popular Name: 3-[[[(1S)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-5,7-dimethyl-carbostyril 3-[[[(1S)-1-(1-tert-amyltetrazol…

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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)	4.29	8.83	-11.86	1	8	0	93	462.598	9	↓ MOL2 SDF SMILES Flexibase

1375235

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-5,7-dimethyl-carbostyril 3-[[[(1R)-1-(1-tert-amyltetrazol…

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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)	4.29	9.47	-17.09	1	8	0	93	462.598	9	↓ MOL2 SDF SMILES Flexibase

1375317

Analogs

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Popular Name: 2-[5-[(1S)-1-[2-furfuryl-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]amino]propyl]tetrazol-1-yl]ac 2-[5-[(1S)-1-[2-furfuryl-[(2-ket…

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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)	2.84	9.03	-14.64	1	10	0	119	478.553	11	↓ MOL2 SDF SMILES Flexibase

1375318

Analogs

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Popular Name: 2-[5-[(1R)-1-[2-furfuryl-[(2-keto-5,7-dimethyl-1H-quinolin-3-yl)methyl]amino]propyl]tetrazol-1-yl]ac 2-[5-[(1R)-1-[2-furfuryl-[(2-ket…

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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)	2.84	9.36	-22.51	1	10	0	119	478.553	11	↓ MOL2 SDF SMILES Flexibase

1375417

Analogs

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Popular Name: 3-[[[(1S)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-7,8-dimethyl-carbostyril 3-[[[(1S)-1-(1-tert-amyltetrazol…

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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)	3.98	9.21	-19.74	1	8	0	93	462.598	9	↓ MOL2 SDF SMILES Flexibase

1375418

Analogs

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Popular Name: 3-[[[(1R)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-7,8-dimethyl-carbostyril 3-[[[(1R)-1-(1-tert-amyltetrazol…

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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)	3.98	8.92	-19.85	1	8	0	93	462.598	9	↓ MOL2 SDF SMILES Flexibase

1375462

Analogs

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Popular Name: 2-[5-[(1S)-1-[2-furfuryl-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]amino]propyl]tetrazol-1-yl]ac 2-[5-[(1S)-1-[2-furfuryl-[(2-ket…

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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)	2.53	9.43	-22.83	1	10	0	119	478.553	11	↓ MOL2 SDF SMILES Flexibase

1375463

Analogs

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Popular Name: 2-[5-[(1R)-1-[2-furfuryl-[(2-keto-7,8-dimethyl-1H-quinolin-3-yl)methyl]amino]propyl]tetrazol-1-yl]ac 2-[5-[(1R)-1-[2-furfuryl-[(2-ket…

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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)	2.53	10.51	-15.41	1	10	0	119	478.553	11	↓ MOL2 SDF SMILES Flexibase

1375555

Analogs

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Popular Name: 3-[[[(1S)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-5,8-dimethyl-carbostyril 3-[[[(1S)-1-(1-tert-butyltetrazo…

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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)	3.78	8.49	-12.11	1	8	0	93	448.571	8	↓ MOL2 SDF SMILES Flexibase

1375556

Analogs

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Popular Name: 3-[[[(1R)-1-(1-tert-butyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-5,8-dimethyl-carbostyril 3-[[[(1R)-1-(1-tert-butyltetrazo…

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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)	3.78	9.09	-17.36	1	8	0	93	448.571	8	↓ MOL2 SDF SMILES Flexibase

1375575

Analogs

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Popular Name: 3-[[[(1S)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-5,8-dimethyl-carbostyril 3-[[[(1S)-1-(1-tert-amyltetrazol…

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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)	4.29	8.95	-11.97	1	8	0	93	462.598	9	↓ MOL2 SDF SMILES Flexibase

1375576

Analogs

Draw Identity 99% 90% 80% 70%

Popular Name: 3-[[[(1R)-1-(1-tert-amyltetrazol-5-yl)propyl]-(2-furfuryl)amino]methyl]-5,8-dimethyl-carbostyril 3-[[[(1R)-1-(1-tert-amyltetrazol…

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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)	4.29	9.59	-17.18	1	8	0	93	462.598	9	↓ MOL2 SDF SMILES Flexibase

Parameters Provided:

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