UCSF

ZINC19536333

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Substance Information

In ZINC since Heavy atoms Benign functionality
November 3rd, 2008 22 Yes

Popular Name: 6,7-Dimethoxy-2-(o-fluorobenzyl)-1,2,3,4-tetrahydroisoquinoline hydrobromide; Bromure de dimethoxy-6,7 tetrahydro-1,2,3,4 ortho-fluorobenzyl-2 isoquinoleine [French]; Isoquinoline, 1,2,3,4-tetrahydro-6,7-dimethoxy-2-(o-fluorobenzyl)-, hydrobromide; LS-859 6,7-Dimethoxy-2-(o-fluorobenzyl)…

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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) 2.87 7.26 -8.81 0 3 0 22 301.361 4 ↓

Vendor Notes

Note Type Comments Provided By
PUBCHEM_PATENT_ID EP0154842A2; US4678792 IBM Patent Data

Activity (Go SEA)

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