PDB CCD ID: | MLG |
Number of entries in BioLiP: | 8 |
Chemical formula: | C13 H15 Cl2 N O |
InChI: | InChI=1S/C13H15Cl2NO/c1-3-7-16(2)8-4-9-17-13-6-5-11(14)10-12(13)15/h1,5-6,10H,4,7-9H2,2H3 |
InChIKey: | BTFHLQRNAMSNLC-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
ACDLabs 10.04 | Clc1cc(Cl)ccc1OCCCN(CC#C)C | OpenEye OEToolkits 1.5.0 | CN(CCCOc1ccc(cc1Cl)Cl)CC#C | OpenEye OEToolkits 1.5.0 | C[N@](CCCOc1ccc(cc1Cl)Cl)CC#C | CACTVS 3.341 | CN(CCCOc1ccc(Cl)cc1Cl)CC#C |
|
Name: | N-[3-(2,4-DICHLOROPHENOXY)PROPYL]-N-METHYL-N-PROP-2-YNYLAMINE; N-METHYL-N-PROPARGYL-3-(2,4-DICHLOROPHENOXY)PROPYLAMINE |
ChEMBL: | CHEMBL8706 |
DrugBank: | DB04017 |
ZINC: | ZINC000022200090 |