UCSF

ZINC09674461

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Substance Information

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

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

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Other Names:

MFCD14749728

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) 2.68 5.66 -15.08 1 8 0 94 418.24 4 ↓
Ref Reference (pH 7) 2.68 5.28 -12.81 1 8 0 94 418.24 4 ↓
Ref Reference (pH 7) 2.68 6.39 -21.07 1 8 0 94 418.24 4 ↓
Ref Reference (pH 7) 2.68 5.27 -14.76 1 8 0 94 418.24 4 ↓

Activity (Go SEA)

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