UCSF

ZINC19938349

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 13th, 2008 39 No

Popular Name: 4-[4-(allyloxy)-3-methylbenzoyl]-5-(4-tert-butylphenyl)-3-hydroxy-1-(3-morpholin-4-ylpropyl)-1,5-dihydro-2H-pyrrol-2-one 4-[4-(allyloxy)-3-methylbenzoyl]…

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Other Names:

MFCD03696129

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) 5.31 11.6 -60.61 0 7 -1 82 531.673 11 ↓
Mid Mid (pH 6-8) 5.31 13.92 -81.36 1 7 0 83 532.681 11 ↓

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