UCSF

ZINC04065868

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 4th, 2005 31 No

Popular Name: cyclohexyl 4-[4-(acetyloxy)phenyl]-2-methyl-5-oxo-1,4,5,6,7,8-hexahydro-3-quinolinecarboxylate cyclohexyl 4-[4-(acetyloxy)pheny…

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Other Names:

MFCD00752926

Download: MOL2 SDF SMILES Flexibase

Annotations

None

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) 4.89 1.49 -12.26 0 6 0 82 423.509 6 ↓
Mid Mid (pH 6-8) 4.89 1.43 -15.99 0 6 0 82 423.509 6 ↓
Mid Mid (pH 6-8) 5.07 2.89 -14.79 0 6 0 82 423.509 6 ↓
Mid Mid (pH 6-8) 5.07 1.54 -12.94 0 6 0 82 423.509 6 ↓

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