UCSF

ZINC23038453

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 24th, 2008 31 No

Popular Name: (2S)-2-[[2-[[4-chloro-3-(trifluoromethyl)phenyl]amino]-2-oxo-ethyl]-methyl-amino]-N-(3-nitrophenyl)p (2S)-2-[[2-[[4-chloro-3-(trifluo…

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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) 4.08 9.55 -65.23 3 8 1 108 459.832 8 ↓
Hi High (pH 8-9.5) 4.08 7.37 -22.62 2 8 0 107 458.824 8 ↓

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