UCSF

ZINC21989677

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
December 11th, 2008 18 Yes

Popular Name: tert-Butyl 7-hydroxy-3,4-dihydroisoquinoline-2(1H)-carboxylate tert-Butyl 7-hydroxy-3,4-dihydro…

Find On: PubMed — Wikipedia — Google

CAS Number: 188576-49-0

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) 2.27 4.78 -9.78 1 4 0 50 249.31 2 ↓

Vendor Notes

Note Type Comments Provided By
MP 134 - 136 Enamine Building Blocks
MP 134...136 Enamine Building Blocks
purity 9.500000000000000e+001 Enamine Building Blocks Enamine Building Blocks

Activity (Go SEA)

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