acriflavine – Acriflavine

Name
WID acriflavine View in model
Name Acriflavine View in model
Traditional name 3,6-diamino-10-methylacridin-10-ium
IUPAC name 3,6-diamino-10-methylacridin-10-ium
Cross references PubChem: 156632, ChEBI: 383703, KEGG: C11273
 
Classification
Type antibiotic_acridine View in model
 
Structure
Empirical formula (pH 7.5) H14C14N3
SMILES (pH 7.5) C[N+]1=C2C=C(C=CC2=CC3=C1C=C(C=C3)N)N
Charge (pH 7.5) 1
Is hydrophobic False View in model
Molecular weight (Da) 224.28 View in model
van der Waals volume 
(pH 7.5; Å3 molecule‑1)
206.24
ΔfG'o (pH 7.5, 25C, I = 0; kJ mol‑1) 1276.30
logP -2.81
logD (pH 7.5) -2.81
 
Function
Reaction participant drug efflux (acriflavine) via sodium antiport
acriflavine[c] + NA[e] ⇒ acriflavine[e] + NA[c]
View in model
 
Comments
Comments DNA intercalator [PUB_0847].
References
  1. Knox C, Law V, Jewison T, Liu P, Ly S, Frolkis A, Pon A, Banco K, Mak C, Neveu V, Djoumbou Y, Eisner R, Guo AC, Wishart DS. DrugBank 3.0: a comprehensive resource for 'omics' research on drugs. Nucleic Acids Res 39, D1035-41 (2011). WholeCell: PUB_0847, PubMed: 21059682

 
Metadata
Created 2012-10-01 15:06:49
Last updated 2012-10-01 15:11:52