UCSF

ZINC35636078

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 10th, 2009 32 Yes

Popular Name: 2-[(4R)-1-allyl-4-(2-chlorophenyl)-2,5-dioxo-4,7-dihydro-3H-pyrrolo[3,4-d]pyrimidin-6-yl]-N-(2-pyrid 2-[(4R)-1-allyl-4-(2-chloropheny…

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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) 2.88 7.89 -20.3 2 8 0 95 451.914 7 ↓
Lo Low (pH 4.5-6) 2.88 8.3 -51.26 3 8 1 96 452.922 7 ↓

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

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