UCSF

ZINC19938543

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Substance Information

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

Popular Name: 5-(4-tert-butylphenyl)-4-(3,4-dimethoxybenzoyl)-1-[2-(dimethylamino)ethyl]-3-hydroxy-1,5-dihydro-2H-pyrrol-2-one 5-(4-tert-butylphenyl)-4-(3,4-di…

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Other Names:

MFCD03501598

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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) 3.76 11.58 -75.22 1 7 0 83 466.578 9 ↓
Hi High (pH 8-9.5) 3.76 9.04 -59.32 0 7 -1 82 465.57 9 ↓
Lo Low (pH 4.5-6) 3.76 10.76 -55.93 2 7 1 81 467.586 9 ↓

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