UCSF

ZINC00107641

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 20 No

Popular Name: (E)-1-(6-methoxy-2,2,4-trimethyl-1-quinolyl)but-2-en-1-one (E)-1-(6-methoxy-2,2,4-trimethyl…

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) 3.52 2.65 -7.81 0 3 0 29 271.36 2 ↓

Activity (Go SEA)

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