UCSF

ZINC65532893

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 19th, 2011 28 Yes

Popular Name: 2-[(3-acetylanilino)carbonyl]cyclohexanecarboxylic acid 2-[(3-acetylanilino)carbonyl]cyc…

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Other Names:

MFCD01034773

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) 2.53 7.4 -53.44 3 6 1 72 383.516 5 ↓
Mid Mid (pH 6-8) 2.53 5.34 -13.44 2 6 0 70 382.508 5 ↓

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

No pre-computed analogs available. Try a structural similarity search.