UCSF

ZINC33551665

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Substance Information

In ZINC since Heavy atoms Benign functionality
July 12th, 2009 33 No

Popular Name: (2S)-2-(3-ethoxyphenyl)-4-hydroxy-3-(5-methylfuran-2-carbonyl)-1-(3-morpholinopropyl)-2H-pyrrol-5-on (2S)-2-(3-ethoxyphenyl)-4-hydrox…

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Download: MOL2 SDF SMILES Flexibase

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) 2.41 6.68 -60.48 0 8 -1 95 453.515 9 ↓
Mid Mid (pH 6-8) 2.41 9.01 -74.62 1 8 0 96 454.523 9 ↓
Lo Low (pH 4.5-6) 2.41 8.19 -48.86 2 8 1 94 455.531 9 ↓

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