UCSF

ZINC13426789

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 19th, 2008 33 No

Popular Name: (5S)-5-(3,4-dimethoxyphenyl)-4-(furan-2-carbonyl)-3-hydroxy-1-(3-morpholinopropyl)-5H-pyrrol-2-one (5S)-5-(3,4-dimethoxyphenyl)-4-(…

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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) 1.43 5.68 -65.01 0 9 -1 105 455.487 9 ↓
Mid Mid (pH 6-8) 1.87 7.3 -60.78 2 9 1 103 457.503 8 ↓
Mid Mid (pH 6-8) 1.43 8.01 -84.81 1 9 0 106 456.495 9 ↓

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