UCSF

ZINC12398887

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
May 12th, 2008 22 Yes

Popular Name: acetic acid, [[2-cyclopentyl-4-(difluoromethyl)-2H-pyrazolo[3,4-b]pyridin-6-yl]thio]- acetic acid, [[2-cyclopentyl-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) 2.85 1.06 -55.02 0 5 -1 71 326.348 5 ↓

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Rings

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

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