UCSF

ZINC40768005

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
April 12th, 2010 27 Yes

Popular Name: 4-methyl-N-[2-oxo-2-[4-(2-pyridyl)piperazin-1-yl]ethyl]furo[3,2-b]pyrrole-5-carboxamide 4-methyl-N-[2-oxo-2-[4-(2-pyridy…

Find On: PubMed — Wikipedia — Google

Download: MOL2 SDF SMILES Flexibase

Annotations

Vendors

    None

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) 0.82 6.69 -41.59 2 8 1 85 368.417 4 ↓
Mid Mid (pH 6-8) 0.82 6.39 -15.05 1 8 0 84 367.409 4 ↓

Activity (Go SEA)

Rings

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

No pre-computed analogs available. Try a structural similarity search.