UCSF

ZINC63720290

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 32 No

Popular Name: N-(4-chloro-3-methyl-phenyl)-2-[[(6R)-4-imino-5-(4-methoxyphenyl)-3-methyl-6H-pyrazolo[3,4-d]pyrimid N-(4-chloro-3-methyl-phenyl)-2-[…

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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) 3.56 6.25 -13.17 2 8 0 104 468.97 6 ↓
Lo Low (pH 4.5-6) 3.56 6.17 -46.96 3 8 1 105 469.978 6 ↓

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

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