UCSF

ZINC64538581

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2011 29 Yes

Popular Name: 3-[(4aS,7aS)-5,6-dimethyl-4-oxo-1,2,4a,7a-tetrahydrofuro[2,3-d]pyrimidin-3-yl]-N-[2-(5-chloro-2H-ind 3-[(4aS,7aS)-5,6-dimethyl-4-oxo-…

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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) 3.08 3.67 -45.45 3 7 1 85 417.917 6 ↓
Lo Low (pH 4.5-6) 3.08 5.55 -100.32 4 7 2 89 418.925 6 ↓

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

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