UCSF

ZINC34670150

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 18th, 2009 33 Yes

Popular Name: 3-[[(2,4-difluorophenyl)methyl-(2-morpholinoethyl)amino]methyl]-N-(2-dimethylaminoethyl)benzamide 3-[[(2,4-difluorophenyl)methyl-(…

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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) 2.47 9.71 -93.73 3 6 2 50 462.585 11 ↓
Hi High (pH 8-9.5) 2.47 7.54 -45.59 2 6 1 49 461.577 11 ↓
Lo Low (pH 4.5-6) 2.47 9.8 -90.55 3 6 2 50 462.585 11 ↓

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