UCSF

ZINC67743603

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 14th, 2011 25 No

Popular Name: 2-[(4-oxopyrido[1,2-a]pyrimidin-2-yl)methylsulfanyl]-N-[(1S)-1-phenylethyl]acetamide 2-[(4-oxopyrido[1,2-a]pyrimidin-…

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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) 2.85 9.28 -20.78 1 5 0 63 353.447 6 ↓
Lo Low (pH 4.5-6) 2.85 9.69 -42.07 2 5 1 65 354.455 6 ↓

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

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