UCSF

ZINC06148796

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 8th, 2006 35 No

Popular Name: cyclohexyl 2-methyl-4-[4-(methyloxy)phenyl]-5-oxo-7-phenyl-1,4,5,6,7,8-hexahydroquinoline-3-carboxylate cyclohexyl 2-methyl-4-[4-(methyl…

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Other Names:

MFCD00771558

Download: MOL2 SDF SMILES Flexibase

Annotations

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Vendors

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 (Ų) MWT Molecular weight (g/mol) RB Rotatable bonds DL
Ref Reference (pH 7) 6.95 0.58 -7.86 0 5 0 64 471.597 6 ↓
Mid Mid (pH 6-8) 7.14 0.81 -8.81 0 5 0 64 471.597 6 ↓
Mid Mid (pH 6-8) 7.14 2.03 -15.5 0 5 0 64 471.597 6 ↓
Mid Mid (pH 6-8) 6.95 0.7 -10.94 0 5 0 64 471.597 6 ↓

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Analogs ( Draw Identity 99% 90% 80% 70% )