UCSF

ZINC66055006

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2011 14 Yes

Popular Name: 6-methyl-3-(trifluoromethyl)-1,4,5,7-tetrahydropyrazolo[3,4-c]pyridine 6-methyl-3-(trifluoromethyl)-1,4…

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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) 1.47 3.94 -39.94 1 3 0 31 205.183 1 ↓
Hi High (pH 8-9.5) 1.47 1.85 -3.56 1 3 0 32 205.183 1 ↓
Mid Mid (pH 6-8) 1.47 4.09 -46.52 2 3 1 33 206.191 1 ↓

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

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