UCSF

ZINC34560941

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 31st, 2009 34 Yes

Popular Name: methyl-[3-[4-(1-naphthyl)piperazin-1-yl]propyl]BLAHone methyl-[3-[4-(1-naphthyl)piperaz…

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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) 3.87 14.23 -54.79 1 6 1 46 474.654 5 ↓
Mid Mid (pH 6-8) 3.87 12.02 -14.84 0 6 0 45 473.646 5 ↓
Lo Low (pH 4.5-6) 3.87 16.66 -97.81 2 6 2 47 475.662 5 ↓

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