UCSF

ZINC22653763

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 18th, 2008 34 Yes

Popular Name: 5-[(2-chlorophenyl)methoxy]-2-[[4-(3-dimethylaminobenzoyl)piperazin-1-yl]methyl]pyran-4-one 5-[(2-chlorophenyl)methoxy]-2-[[…

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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) 2.61 10.63 -17.96 0 7 0 66 481.98 7 ↓
Mid Mid (pH 6-8) 2.61 12.91 -63.67 1 7 1 67 482.988 7 ↓

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

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