UCSF

ZINC49551615

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 30 Yes

Popular Name: (5S)-1-isopentyl-2,4,7-trioxo-N-(2,3,4-trifluorophenyl)-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-5-car (5S)-1-isopentyl-2,4,7-trioxo-N-…

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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) 1.71 3.33 -17.83 3 8 0 117 424.379 5 ↓
Ref Reference (pH 7) 2.16 5.17 -32.45 2 8 -1 119 423.371 5 ↓

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

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