UCSF

ZINC06498869

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 3rd, 2006 33 No

Popular Name: 3-hydroxy-5-(4-hydroxy-3-methoxy-phenyl)-4-(4-isopropoxybenzoyl)-1-(3-methoxypropyl)-5H-pyrrol-2-one 3-hydroxy-5-(4-hydroxy-3-methoxy…

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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) 2.77 6.48 -43.47 1 8 -1 108 454.499 10 ↓
Mid Mid (pH 6-8) 3.21 4.96 -30.32 2 8 0 106 455.507 9 ↓
Mid Mid (pH 6-8) 2.18 5.95 -25.32 1 8 0 102 455.507 10 ↓

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