UCSF

ZINC21527879

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 33 Yes

Popular Name: N-[2-(4-methylpiperazin-1-yl)ethyl]-4-[(oxoBLAHyl)methyl]benzamide N-[2-(4-methylpiperazin-1-yl)eth…

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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) 2.90 10.18 -49.98 2 8 1 76 445.547 6 ↓
Mid Mid (pH 6-8) 2.90 10.05 -51.67 2 8 1 76 445.547 6 ↓
Mid Mid (pH 6-8) 2.90 7.71 -18.17 1 8 0 75 444.539 6 ↓

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