UCSF

ZINC61377968

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 9th, 2011 27 Yes

Popular Name: 3-(1,3-dimethyl-2,4-dioxo-pyrido[2,3-d]pyrimidin-6-yl)-1-methyl-1-[2-(2-pyridyl)ethyl]urea 3-(1,3-dimethyl-2,4-dioxo-pyrido…

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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) 0.40 6.85 -17.13 1 9 0 102 368.397 4 ↓
Lo Low (pH 4.5-6) 0.40 7.21 -41.89 2 9 1 103 369.405 4 ↓

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

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