UCSF

ZINC67754615

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 15th, 2011 22 Yes

Popular Name: 2-(2-tert-butyl-5,7-dihydropyrrolo[3,4-d]pyrimidin-6-yl)pyridine-3-carboxamide 2-(2-tert-butyl-5,7-dihydropyrro…

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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) 1.05 5.15 -13.95 2 6 0 85 297.362 3 ↓
Lo Low (pH 4.5-6) 1.05 5.62 -44.01 3 6 1 86 298.37 3 ↓

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

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