UCSF

ZINC01722133

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 8th, 2004 22 No

Popular Name: 2-(3,4-Dihydroxyphenethyl)aminomethyl-1,2,3,4-tetrahydroquinoline dihydrobromide; LS-142153; NSC 135794; Pyrocatechol, 4-(2-(((1,2,3,4-tetrahydro-2-quinolyl)methyl)amino)ethyl)-, dihydrobromide; Quinoline, 1,2,3,4-tetrahydro-2-((3,4-dihydroxyphenethylamin 2-(3,4-Dihydroxyphenethyl)aminom…

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) 3.23 -5.06 -54.74 5 4 1 69 299.394 5 ↓

Activity (Go SEA)

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