UCSF

ZINC06621788

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Substance Information

In ZINC since Heavy atoms Benign functionality
April 10th, 2006 31 No

Popular Name: 4-[4-(allyloxy)benzoyl]-1-[3-(dimethylamino)propyl]-3-hydroxy-5-(4-pyridinyl)-1,5-dihydro-2H-pyrrol-2-one 4-[4-(allyloxy)benzoyl]-1-[3-(di…

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Other Names:

MFCD03501945

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Annotations

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Vendors

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) 2.54 0.82 -47.78 2 7 1 84 422.505 9 ↓
Mid Mid (pH 6-8) 1.51 0.64 -46.62 1 7 1 81 422.505 10 ↓
Lo Low (pH 4.5-6) 2.54 0.78 -118.33 3 7 2 85 423.513 9 ↓

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