UCSF

ZINC63731805

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 4th, 2011 31 No

Popular Name: 2-[[(6S)-4-imino-3-methyl-5-(m-tolyl)-6H-pyrazolo[3,4-d]pyrimidin-6-yl]sulfanyl]-N-phenethyl-acetami 2-[[(6S)-4-imino-3-methyl-5-(m-t…

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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) 2.98 7.43 -12.94 2 7 0 94 432.553 7 ↓
Lo Low (pH 4.5-6) 2.98 7.36 -44.4 3 7 1 96 433.561 7 ↓

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

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