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| Duplicate ID | |
|---|---|
| Molecule Name | EiM08-09002 |
| (4-(3-chlorophenyl)piperazin-1-yl)(2-(pyridin-3-yl)quinolin-4-yl)methanone | |
| Smiles | Clc1cccc(c1)N1CCN(CC1)C(=O)c1cc(nc2c1cccc2)c1cccnc1 |
| Cas Number | |
| InchiKey | YUNFLKHRNNLKRL-UHFFFAOYSA-N |
| InChi | InChI=1S/C25H21ClN4O/c26-19-6-3-7-20(15-19)29-11-13-30(14-12-29)25(31)22-16-24(18-5-4-10-27-17-18)28-23-9-2-1-8-21(22)23/h1-10,15-17H,11-14H2 |
| Formula | C25H21ClN4O |
| Molecular weight | 428.913 |
| Rings | 5 |
| logP | 4.9155 |
| PSA | 49.33 |
| MR | 131.152 |