UCSF

ZINC23935203

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
January 10th, 2009 27 Yes

Popular Name: 4-chloro-N-[(5,7-dimethyl-[1,2,4]triazolo[4,5-a]pyrimidin-3-yl)methyl]-2-(trifluoromethyl)benzenesul 4-chloro-N-[(5,7-dimethyl-[1,2,4…

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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) 2.58 8.37 -22.94 1 7 0 89 419.816 5 ↓
Hi High (pH 8-9.5) 2.58 8.11 -50.52 0 7 -1 91 418.808 5 ↓

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

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