UCSF

ZINC67447151

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 9th, 2011 24 Yes

Popular Name: 4-[1-[(4-fluorophenyl)methyl]-4,6-dihydropyrrolo[3,4-c]pyrazol-5-yl]-6-methyl-pyrimidin-2-amine 4-[1-[(4-fluorophenyl)methyl]-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) 1.89 9.56 -38.26 3 6 1 74 325.371 3 ↓
Hi High (pH 8-9.5) 1.89 9.54 -37.97 3 6 1 74 325.371 3 ↓
Mid Mid (pH 6-8) 1.89 9.11 -12.13 2 6 0 73 324.363 3 ↓

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

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