UCSF

ZINC06015531

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Substance Information

In ZINC since Heavy atoms Benign functionality
February 24th, 2006 36 No

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

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Other Names:

MFCD02732029

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) 6.42 13.44 -10.83 0 6 0 74 510.03 8 ↓
Mid Mid (pH 6-8) 6.42 13.41 -14.5 0 6 0 74 510.03 8 ↓
Mid Mid (pH 6-8) 6.60 14.11 -12.41 0 6 0 74 510.03 8 ↓
Mid Mid (pH 6-8) 6.60 13.25 -12.51 0 6 0 74 510.03 8 ↓

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