UCSF

ZINC34689369

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
September 23rd, 2009 20 Yes

Popular Name: 1,2,3,4-Tetrahydro-N-(2-(diethylamino)ethyl)-3-isoquinolinecarboxamide; 3-Isoquinolinecarboxamide, 1,2,3,4-tetrahydro-N-(2-(diethylamino)ethyl)-; BRN 0420558; LS-85424; N-(2-Diethylamino)ethyl-1,2,3,4-tetrahydro-3-isoquinolinecarboxamide; N-(2-Dietilammin 1,2,3,4-Tetrahydro-N-(2-(diethyl…

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) 1.36 5.1 -40.39 3 4 1 46 276.404 6 ↓

Activity (Go SEA)

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