UCSF

ZINC67946151

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 17th, 2011 27 Yes

Popular Name: 5-(4-cyclobutyl-6-methyl-pyrimidin-2-yl)-1-[(4-fluorophenyl)methyl]-4,6-dihydropyrrolo[3,4-c]pyrazol 5-(4-cyclobutyl-6-methyl-pyrimid…

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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) 3.70 12.97 -9.98 0 5 0 47 363.44 4 ↓
Lo Low (pH 4.5-6) 3.70 13.35 -32.83 1 5 1 48 364.448 4 ↓
Lo Low (pH 4.5-6) 3.70 13.36 -34.32 1 5 1 48 364.448 4 ↓

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

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