UCSF

ZINC62594921

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 3rd, 2011 34 No

Popular Name: N-(1,5-dimethyl-3-oxo-2-phenyl-pyrazol-4-yl)-4-[[(2S)-2-hydroxy-2-methyl-butyl]amino]-3-nitro-benzen N-(1,5-dimethyl-3-oxo-2-phenyl-p…

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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) 2.52 6.19 -30.67 3 11 0 151 489.554 9 ↓
Hi High (pH 8-9.5) 2.52 6.73 -71.15 2 11 -1 153 488.546 9 ↓

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

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