PDB CCD ID: | IP6 |
Number of entries in BioLiP: | 1 |
Chemical formula: | C20 H18 N4 |
InChI: | InChI=1S/C20H18N4/c21-20-18(5-2-9-23-20)24-13-14-3-1-4-16(11-14)17-7-6-15-8-10-22-19(15)12-17/h1-12,22,24H,13H2,(H2,21,23) |
InChIKey: | LPQUIIHPUGDHJK-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
---|
OpenEye OEToolkits 1.5.0 | c1cc(cc(c1)c2ccc3cc[nH]c3c2)CNc4cccnc4N | CACTVS 3.341 | Nc1ncccc1NCc2cccc(c2)c3ccc4cc[nH]c4c3 | ACDLabs 10.04 | n1cccc(c1N)NCc4cccc(c2ccc3c(c2)ncc3)c4 |
|
Name: | N~3~-[3-(1H-INDOL-6-YL)BENZYL]PYRIDINE-2,3-DIAMINE |
ChEMBL: | CHEMBL220896 |
DrugBank: | DB07993 |
ZINC: | ZINC000011525589 |