UCSF

ZINC52872581

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 14th, 2010 23 Yes

Popular Name: 2-[(9-methyl-4-oxo-pyrido[1,2-a]pyrimidin-2-yl)methylamino]benzamide 2-[(9-methyl-4-oxo-pyrido[1,2-a]…

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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) 1.72 5.24 -33.19 4 6 1 91 309.349 4 ↓
Mid Mid (pH 6-8) 1.72 4.92 -18.18 3 6 0 89 308.341 4 ↓

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

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