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| Duplicate ID | |
|---|---|
| Molecule Name | (1r,4r)-N-(2-(1H-indol-3-yl)ethyl)-4-((4-oxobenzo[d][1,2,3]triazin-3(4H)-yl)methyl)cyclohexanecarboxamide |
| Smiles | O=C([C@@H]1CC[C@H](CC1)Cn1nnc2c(c1=O)cccc2)NCCc1c[nH]c2c1cccc2 |
| Cas Number | |
| InchiKey | KUVIGVRNNXOUSM-IYARVYRRSA-N |
| InChi | InChI=1S/C25H27N5O2/c31-24(26-14-13-19-15-27-22-7-3-1-5-20(19)22)18-11-9-17(10-12-18)16-30-25(32)21-6-2-4-8-23(21)28-29-30/h1-8,15,17-18,27H,9-14,16H2,(H,26,31)/t17-,18- |
| Formula | C25H27N5O2 |
| Molecular weight | 429.514 |
| Rings | 5 |
| logP | 3.829 |
| PSA | 92.67 |
| MR | 125.554 |