UCSF

ZINC49551660

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Substance Information

In ZINC since Heavy atoms Benign functionality
October 5th, 2010 32 Yes

Popular Name: (5R)-N-(3-methylsulfanylphenyl)-2,4,7-trioxo-1-phenethyl-6,8-dihydro-5H-pyrido[2,3-d]pyrimidine-5-ca (5R)-N-(3-methylsulfanylphenyl)-…

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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) 1.92 5.84 -19.9 3 8 0 117 450.52 6 ↓
Ref Reference (pH 7) 2.37 6.57 -41.06 2 8 -1 119 449.512 6 ↓

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

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