UCSF

ZINC13537159

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Substance Information

In ZINC since Heavy atoms Benign functionality
June 21st, 2008 31 No

Popular Name: (5S)-3-hydroxy-5-(3-methoxyphenyl)-4-(5-methylfuran-2-carbonyl)-1-(2-morpholinoethyl)-5H-pyrrol-2-on (5S)-3-hydroxy-5-(3-methoxypheny…

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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) 1.77 4.94 -59.42 0 8 -1 95 425.461 7 ↓
Mid Mid (pH 6-8) 1.77 7.19 -67.61 1 8 0 96 426.469 7 ↓
Lo Low (pH 4.5-6) 1.77 6.44 -46.52 2 8 1 94 427.477 7 ↓

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