UCSF

ZINC09360154

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 23rd, 2007 30 No

Popular Name: 5-(2,5-dimethoxyphenyl)-4-(2-furoyl)-3-hydroxy-1-[2-(2-hydroxyethoxy)ethyl]-1,5-dihydro-2H-pyrrol-2-one 5-(2,5-dimethoxyphenyl)-4-(2-fur…

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Other Names:

MFCD04025160

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) 0.94 2.69 -74.49 1 9 -1 122 416.406 10 ↓
Mid Mid (pH 6-8) 0.94 3.4 -18.16 2 9 0 119 417.414 10 ↓
Mid Mid (pH 6-8) 0.35 3.92 -15.44 1 9 0 116 417.414 10 ↓

Activity (Go SEA)

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