UCSF

ZINC09674455

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Substance Information

In ZINC since Heavy atoms Benign functionality
September 6th, 2007 28 No

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

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Other Names:

MFCD14749727

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) 2.71 5.37 -12.71 1 8 0 94 418.24 4 ↓
Ref Reference (pH 7) 2.71 5.04 -10.82 1 8 0 94 418.24 4 ↓
Ref Reference (pH 7) 2.71 6.02 -18.9 1 8 0 94 418.24 4 ↓
Ref Reference (pH 7) 2.71 5.03 -12.56 1 8 0 94 418.24 4 ↓

Activity (Go SEA)

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