UCSF

ZINC13127724

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Substance Information

In ZINC since Heavy atoms Benign functionality
May 29th, 2008 31 No

Popular Name: 4-(3,4-dimethoxybenzoyl)-1-[3-(dimethylamino)propyl]-3-hydroxy-5-phenyl-1,5-dihydro-2H-pyrrol-2-one 4-(3,4-dimethoxybenzoyl)-1-[3-(d…

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Other Names:

MFCD03501572

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) 2.33 9.69 -79.37 1 7 0 83 424.497 9 ↓
Lo Low (pH 4.5-6) 2.33 8.95 -54.82 2 7 1 81 425.505 9 ↓

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