UCSF

ZINC21784478

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 9th, 2008 26 Yes

Popular Name: (5R)-2-allylsulfanyl-5-(2-isopropoxyphenyl)-3,5,6,8-tetrahydropyrido[5,6-e]pyrimidine-4,7-dione (5R)-2-allylsulfanyl-5-(2-isopro…

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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) 3.47 7.59 -10.97 2 6 0 84 371.462 6 ↓
Mid Mid (pH 6-8) 3.47 7.06 -17.52 2 6 0 84 371.462 6 ↓
Mid Mid (pH 6-8) 3.93 5.66 -46.47 1 6 -1 87 370.454 6 ↓

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