UCSF

ZINC21538269

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Substance Information

In ZINC since Heavy atoms Benign functionality
December 6th, 2008 32 Yes

Popular Name: (5R)-5-benzyl-3-(m-tolyl)-2-(4-pyrimidin-2-ylpiperazin-1-yl)-5H-imidazol-4-one (5R)-5-benzyl-3-(m-tolyl)-2-(4-p…

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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) 3.68 13.69 -10.63 0 7 0 65 426.524 5 ↓
Mid Mid (pH 6-8) 1.21 15.34 -17.37 1 7 0 75 426.524 5 ↓
Lo Low (pH 4.5-6) 1.21 13.16 -34.93 2 7 1 76 427.532 5 ↓

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