UCSF

ZINC16693968

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 5th, 2008 21 No

Popular Name: (5Z)-5-[[(2-chlorophenyl)amino]methylene]-1,4-dimethyl-2,6-dioxo-pyridine-3-carbonitrile (5Z)-5-[[(2-chlorophenyl)amino]m…

Find On: PubMed — Wikipedia — Google

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) 2.21 7.12 -22.23 1 5 0 75 301.733 2 ↓
Hi High (pH 8-9.5) 2.73 6.13 -37.81 0 5 -1 81 300.725 2 ↓

Activity (Go SEA)

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