UCSF

ZINC55455050

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 14th, 2010 29 Yes

Popular Name: N-[[4-(4-fluorophenyl)tetrahydropyran-4-yl]methyl]-2,4-dioxo-1H-pyrido[2,3-d]pyrimidine-6-carboxamid N-[[4-(4-fluorophenyl)tetrahydro…

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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) 1.58 1.29 -42.12 2 8 -1 120 397.386 4 ↓
Lo Low (pH 4.5-6) 1.12 3.23 -14.71 3 8 0 117 398.394 4 ↓

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

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