GMQ   

GtoPdb Ligand ID: 4203

Synonyms: 2-GMQ | 2-guanidine-4-methylquinazoline | GNF-Pf-3515
Compound class: Synthetic organic
2D Structure
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Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 2
Topological polar surface area 87.68
Molecular weight 201.1
XLogP 1.49
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES NC(=N)Nc1nc2ccccc2c(n1)C
Isomeric SMILES NC(=N)Nc1nc2ccccc2c(n1)C
InChI InChI=1S/C10H11N5/c1-6-7-4-2-3-5-8(7)14-10(13-6)15-9(11)12/h2-5H,1H3,(H4,11,12,13,14,15)
InChI Key ONQKSKDLYYDFLL-UHFFFAOYSA-N
Classification
Compound class Synthetic organic
IUPAC Name
1-(4-methylquinazolin-2-yl)guanidine
Synonyms
2-GMQ | 2-guanidine-4-methylquinazoline | GNF-Pf-3515
Database Links
CAS Registry No. 716-11-0
ChEMBL Ligand CHEMBL602365
GtoPdb PubChem SID 178101020
PubChem CID 345657
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