UCSF

ZINC15444725

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 25th, 2008 33 No

Popular Name: 2-[[2-[[2-[(4-chlorophenyl)amino]-2-oxo-ethyl]-methyl-amino]acetyl]amino]-N-(4-fluorophenyl)benzamid 2-[[2-[[2-[(4-chlorophenyl)amino…

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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) 4.37 10.1 -52.36 4 7 1 92 469.924 8 ↓
Hi High (pH 8-9.5) 4.19 7.15 -58.2 2 7 -1 97 467.908 8 ↓
Hi High (pH 8-9.5) 4.19 9.44 -42.78 3 7 0 98 468.916 8 ↓

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