UCSF

ZINC18217599

Draw Identity 99% 90% 80% 70%

Substance Information

In ZINC since Heavy atoms Benign functionality
October 4th, 2008 17 Yes

Popular Name: 4-Methyl-2-piperazin-1-yl-quinoline 4-Methyl-2-piperazin-1-yl-quinoline

Find On: PubMed — Wikipedia — Google

CAS Numbers: 1071545-91-9 , 326827-21-8 , 50693-78-2 , 5094-33-7

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) 2.36 5.48 -43.82 2 3 1 33 228.319 1 ↓
Hi High (pH 8-9.5) 2.36 5.35 -7.82 1 3 0 28 227.311 1 ↓
Hi High (pH 8-9.5) 2.36 5.66 -22.95 2 3 1 29 228.319 1 ↓

Vendor Notes

Note Type Comments Provided By
BP 432° Matrix Scientific
Purity 97% Fluorochem
Warnings IRRITANT Matrix Scientific

Activity (Go SEA)

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