UCSF

ZINC19938346

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 34 No

Popular Name: 1-[2-(diethylamino)ethyl]-5-(4-ethoxyphenyl)-3-hydroxy-4-(4-methoxy-3-methylbenzoyl)-1,5-dihydro-2H-pyrrol-2-one 1-[2-(diethylamino)ethyl]-5-(4-e…

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Other Names:

MFCD03301373

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) 4.03 11.35 -74.25 1 7 0 83 466.578 11 ↓
Hi High (pH 8-9.5) 4.03 9.06 -58.2 0 7 -1 82 465.57 11 ↓
Lo Low (pH 4.5-6) 4.03 10.53 -54.96 2 7 1 81 467.586 11 ↓

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