UCSF

ZINC00029766

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
July 23rd, 2004 19 Yes

Popular Name: 3,4-dihydro-1H-isoquinolin-2-yl-(4-fluorophenyl)methanone 3,4-dihydro-1H-isoquinolin-2-yl-…

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) 2.46 1.31 -8.09 0 2 0 20 255.292 1 ↓

Activity (Go SEA)

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