Bioactive Compound Details
| BioID | bio3472 |
|---|---|
| Name | DASMINAPANT |
| ChEMBL ID | CHEMBL5314514 |
| Molecular Formula | C60H72N10O10S2 |
| Molecular Weight | 1157.43 |
| Molecular Weight (Monoisotopic) | 1156.4874 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar18 |
| Target Name | Serine/threonine-protein kinase cot (COT) |
| Synonyms | DASMINAPANT |
| Smiles | CN[C@@H](C)C(=O)N[C@H]1CN(S(=O)(=O)c2cccc(S(=O)(=O)N3CC[C@H]4CC[C@@H](C(=O)NC(c5ccccc5)c5ccccc5)N4C(=O)[C@@H](NC(=O)[C@H](C)NC)C3)c2)CC[C@H]2[C@@H](C(=O)NC(c3ccccc3)c3ccccc3)CCN2C1=O |
| Inchi | InChI=1S/C60H72N10O10S2/c1-39(61-3)55(71)63-49-37-68(34-32-51-48(31-35-69(51)59(49)75)57(73)65-53(41-18-9-5-10-19-41)42-20-11-6-12-21-42)82(79,80)47-27-17-26-46(36-47)81(77,78)67-33-30-45-28-29-52(70(45)60(76)50(38-67)64-56(72)40(2)62-4)58(74)66-54(43-22-13-7-14-23-43)44-24-15-8-16-25-44/h5-27,36,39-40,45,48-54,61-62H,28-35,37-38H2,1-4H3,(H,63,71)(H,64,72)(H,65,73)(H,66,74)/t39-,40-,45+,48-,49-,50-,51-,52-/m0/s1 |
| Inchi Key | CKSCGAMVWBCIEP-GTOFBIKUSA-N |
| Molecular Species | None |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | None |
| Records Key | ['DASMINAPANT'] |
| Records Name | ['DASMINAPANT'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
