UCSF

ZINC13682186

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
June 23rd, 2008 35 Yes

Popular Name: (4R)-1-(4-fluorophenyl)-4-[2-[(2-fluorophenyl)methoxy]-3-methoxy-phenyl]-3-methyl-5,7-dihydro-4H-pyr (4R)-1-(4-fluorophenyl)-4-[2-[(2…

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) 4.69 10.82 -11.33 1 6 0 69 475.495 6 ↓
Ref Reference (pH 7) 4.50 13.24 -10.8 1 6 0 65 475.495 6 ↓

Activity (Go SEA)

Rings

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

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