UCSF

ZINC04171619

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
November 11th, 2005 28 No

Popular Name: acetyl-ethyl-dimethyl-phenyl-BLAHdione acetyl-ethyl-dimethyl-phenyl-BLA…

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) 2.08 1.85 -13.39 0 9 0 94 380.408 2 ↓
Mid Mid (pH 6-8) 2.08 2.11 -25.96 1 9 1 95 381.416 2 ↓

Activity (Go SEA)

Rings

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