UCSF

ZINC50665548

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 21st, 2010 29 Yes

Popular Name: 1-isobutyl-7-isopropyl-2,4-dioxo-N-[2-oxo-2-(prop-2-ynylamino)ethyl]pyrido[2,3-d]pyrimidine-5-carbox 1-isobutyl-7-isopropyl-2,4-dioxo…

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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) 1.30 5.27 -13.95 3 9 0 126 399.451 7 ↓
Mid Mid (pH 6-8) 1.76 2.85 -57.38 2 9 -1 129 398.443 7 ↓

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

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