UCSF

ZINC09329278

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Substance Information

In ZINC since Heavy atoms Benign functionality
August 18th, 2007 27 No

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

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Other Names:

MFCD04014605

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) 2.21 5.19 -64.42 1 6 -1 90 406.867 8 ↓
Mid Mid (pH 6-8) 1.63 -4.08 -15.12 1 6 0 83 407.875 8 ↓
Lo Low (pH 4.5-6) 2.21 4.37 -19.05 2 6 0 87 407.875 8 ↓

Activity (Go SEA)

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