| PDB CCD ID: | FR7 |
| Number of entries in BioLiP: | 1 |
| Chemical formula: | C15 H17 Cl2 N3 O2 |
| InChI: | InChI=1S/C15H17Cl2N3O2/c1-9(21)13(20-7-12(15(18)22)19-8-20)6-5-10-3-2-4-11(16)14(10)17/h2-4,7-9,13,21H,5-6H2,1H3,(H2,18,22)/t9-,13+/m0/s1 |
| InChIKey: | HCJYSIGJDKNVRU-TVQRCGJNSA-N |
| SMILES: | | Software | SMILES |
|---|
| OpenEye OEToolkits 1.5.0 | CC(C(CCc1cccc(c1Cl)Cl)n2cc(nc2)C(=O)N)O | | CACTVS 3.341 | C[CH](O)[CH](CCc1cccc(Cl)c1Cl)n2cnc(c2)C(N)=O | | ACDLabs 10.04 | Clc1cccc(c1Cl)CCC(n2cc(nc2)C(=O)N)C(O)C | | OpenEye OEToolkits 1.5.0 | C[C@@H]([C@@H](CCc1cccc(c1Cl)Cl)n2cc(nc2)C(=O)N)O | | CACTVS 3.341 | C[C@H](O)[C@@H](CCc1cccc(Cl)c1Cl)n2cnc(c2)C(N)=O |
|
| Name: | 1-{(1R,2S)-1-[2-(2,3,-DICHLOROPHENYL)ETHYL]-2-HYDROXYPROPYL}-1H-IMIDAZOLE-4-CARBOXAMIDE;
FR239087 |
| ChEMBL: | CHEMBL328139 |
| DrugBank: | DB03370 |
| ZINC: | ZINC000000025432 |
zhanggroup.org