UCSF

ZINC02783682

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2004 27 No

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

Find On: PubMed — Wikipedia — Google

Other Names:

MFCD04049549

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) 1.87 4.91 -14.97 1 8 0 94 363.377 4 ↓
Ref Reference (pH 7) 1.87 4.57 -13.41 1 8 0 94 363.377 4 ↓
Ref Reference (pH 7) 1.87 5.57 -22.29 1 8 0 94 363.377 4 ↓
Ref Reference (pH 7) 1.87 4.57 -15.49 1 8 0 94 363.377 4 ↓

Activity (Go SEA)

Rings

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