UCSF

ZINC09707555

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 7th, 2007 33 No

Popular Name: (3,4-dichlorophenyl)methyl-(4-fluorophenyl)-dimethyl-BLAHdione (3,4-dichlorophenyl)methyl-(4-fl…

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) 4.70 1.37 -11.51 0 8 0 77 487.322 3 ↓
Mid Mid (pH 6-8) 4.70 1.81 -41.64 1 8 1 78 488.33 3 ↓

Activity (Go SEA)

Rings

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

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