UCSF

ZINC60021671

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Substance Information

In ZINC since Heavy atoms Benign functionality
March 13th, 2011 27 Yes

Popular Name: 2-[[(2R)-2-[4-(2-methoxyphenyl)piperazin-1-yl]propyl]amino]benzamide 2-[[(2R)-2-[4-(2-methoxyphenyl)p…

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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) 2.52 6.83 -31.04 4 6 1 72 369.489 7 ↓
Mid Mid (pH 6-8) 2.52 4.8 -9.38 3 6 0 71 368.481 7 ↓

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

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