UCSF

ZINC66139190

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
August 19th, 2011 38 No

Popular Name: N-(5-amino-1-benzyl-pyrazol-4-yl)-5-[[4-chloro-3-(trifluoromethyl)phenyl]carbamoylamino]-2-methyl-be N-(5-amino-1-benzyl-pyrazol-4-yl…

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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) 5.49 10.38 -17.65 5 8 0 114 542.949 7 ↓
Lo Low (pH 4.5-6) 5.49 10.55 -35.37 6 8 1 115 543.957 7 ↓

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

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