UCSF

ZINC04852075

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Substance Information

In ZINC since Heavy atoms Benign functionality
January 8th, 2006 30 No

Popular Name: 2-[5-(3,5-dimethylphenyl)-4,6-dioxo-4,5,6,6a-tetrahydropyrrolo[3,4-d][1,2,3]triazol-1(3aH)-yl]-N-(4-ethylphenyl)acetamide 2-[5-(3,5-dimethylphenyl)-4,6-di…

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Other Names:

MFCD07650242

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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) 3.17 7.68 -22.6 1 8 0 94 405.458 5 ↓
Ref Reference (pH 7) 3.17 7.05 -15.11 1 8 0 94 405.458 5 ↓
Ref Reference (pH 7) 3.17 6.57 -15.03 1 8 0 94 405.458 5 ↓
Ref Reference (pH 7) 3.17 6.53 -12.61 1 8 0 94 405.458 5 ↓

Activity (Go SEA)

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