UCSF

ZINC66865215

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 2nd, 2011 28 Yes

Popular Name: (2S)-N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-2-[methyl-[(5-methyl-2-furyl)methyl]amino]propanam (2S)-N-(1,5-dimethyl-3-oxo-2-phe…

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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) 1.74 9.48 -53.92 2 7 1 74 383.472 6 ↓
Hi High (pH 8-9.5) 1.74 7.18 -29.65 1 7 0 72 382.464 6 ↓
Mid Mid (pH 6-8) 1.93 8.58 -51.72 1 7 0 80 382.464 6 ↓

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

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