derivative 17 [Nakahata et al., 2018]
derivative 17 [Nakahata et al., 2018]
| SMILES | Cc1nn(-c2cccc3cc(Cc4cccc(C(F)(F)F)c4)sc23)c(CO)c1C(=O)NCCO |
| InChIKey | VJMRKWPMFQGIPI-UHFFFAOYSA-N |
Chemical Properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 3 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 489.1 |
No bioactivity data available.
derivative 17 [Nakahata et al., 2018]
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Distribution across phases (no. indications)
Phase I
0
Phase II
0
Phase III
0
Phase IV
0