PDB CCD ID: | SCW |
Number of entries in BioLiP: | 1 |
Chemical formula: | C18 H14 Br N5 |
InChI: | InChI=1S/C18H14BrN5/c19-17-10-23-18-16(22-9-13-7-20-12-21-8-13)6-15(11-24(17)18)14-4-2-1-3-5-14/h1-8,10-12,22H,9H2 |
InChIKey: | LZLKFNBMXXLTLX-UHFFFAOYSA-N |
SMILES: | Software | SMILES |
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ACDLabs 10.04 | Brc1cnc2c(cc(cn12)c3ccccc3)NCc4cncnc4 | CACTVS 3.341 | Brc1cnc2n1cc(cc2NCc3cncnc3)c4ccccc4 | OpenEye OEToolkits 1.5.0 | c1ccc(cc1)c2cc(c3ncc(n3c2)Br)NCc4cncnc4 |
|
Name: | 3-bromo-6-phenyl-N-(pyrimidin-5-ylmethyl)imidazo[1,2-a]pyridin-8-amine |
DrugBank: | DB08537 |
ZINC: | ZINC000003820146 |