UCSF

ZINC08432407

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 14th, 2006 35 No

Popular Name: 2-ethoxyethyl 7-(4-chlorophenyl)-4-(3-methoxyphenyl)-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate 2-ethoxyethyl 7-(4-chlorophenyl)…

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Other Names:

MFCD01823932

Download: MOL2 SDF SMILES Flexibase

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) 5.87 0.41 -14.16 0 6 0 74 496.003 9 ↓
Mid Mid (pH 6-8) 5.87 0.05 -16.76 0 6 0 74 496.003 9 ↓
Mid Mid (pH 6-8) 6.06 -0.96 -14.19 0 6 0 74 496.003 9 ↓

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