| PDB CCD ID: | 7XE |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C14 H15 Cl N4 O |
| InChI: | InChI=1S/C14H15ClN4O/c1-19-14(20)13(15)12(8-17-19)18-11-3-2-10-7-16-5-4-9(10)6-11/h2-3,6,8,16,18H,4-5,7H2,1H3 |
| InChIKey: | QFMNJCUEVHZUMC-UHFFFAOYSA-N |
| SMILES: | | Software | SMILES |
|---|
| CACTVS 3.385 | CN1N=CC(=C(Cl)C1=O)Nc2ccc3CNCCc3c2 | | OpenEye OEToolkits 2.0.7 | CN1C(=O)C(=C(C=N1)Nc2ccc3c(c2)CCNC3)Cl | | ACDLabs 12.01 | CN1N=CC(Nc2cc3CCNCc3cc2)=C(Cl)C1=O |
|
| Name: | 4-chloro-2-methyl-5-[(1,2,3,4-tetrahydroisoquinolin-6-yl)amino]pyridazin-3(2H)-one |
| ChEMBL: | CHEMBL4850516 |
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