UCSF

ZINC52431863

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 9th, 2010 26 No

Popular Name: (3-methoxy-4-methyl-phenyl)-[4-(5-nitro-2-pyridyl)piperazin-1-yl]methanone (3-methoxy-4-methyl-phenyl)-[4-(…

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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) 2.16 8.67 -15.05 0 8 0 91 356.382 4 ↓

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Rings

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

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