UCSF

ZINC21784123

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2008 23 Yes

Popular Name: (5S)-5-(3-hydroxyphenyl)-2-propylsulfanyl-3,5,6,8-tetrahydropyrido[5,6-e]pyrimidine-4,7-dione (5S)-5-(3-hydroxyphenyl)-2-propy…

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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) 2.91 2.91 -42.67 2 6 -1 98 330.389 4 ↓
Mid Mid (pH 6-8) 2.46 4.02 -14.05 3 6 0 95 331.397 4 ↓
Mid Mid (pH 6-8) 2.46 3.47 -17.17 3 6 0 95 331.397 4 ↓

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