Bioactive Compound Details
| BioID | bio198995 |
|---|---|
| Name | LISSOCLINAMIDE 2 |
| ChEMBL ID | CHEMBL1791284 |
| Molecular Formula | C33H41N7O5S2 |
| Molecular Weight | 679.87 |
| Molecular Weight (Monoisotopic) | 679.2611 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | Lissoclinamide 2 |
| Smiles | CC[C@@H](C)[C@H]1NC(=O)[C@H]2N=C(O[C@@H]2C)[C@@H]2CCCN2C(=O)[C@H](Cc2ccccc2)NC(=O)c2csc(n2)[C@@H](C)NC(=O)C2CSC1=N2 |
| Inchi | InChI=1S/C33H41N7O5S2/c1-5-17(2)25-32-37-22(16-47-32)27(41)34-18(3)31-36-23(15-46-31)28(42)35-21(14-20-10-7-6-8-11-20)33(44)40-13-9-12-24(40)30-39-26(19(4)45-30)29(43)38-25/h6-8,10-11,15,17-19,21-22,24-26H,5,9,12-14,16H2,1-4H3,(H,34,41)(H,35,42)(H,38,43)/t17-,18-,19-,21+,22?,24+,25-,26+/m1/s1 |
| Inchi Key | MXZCBFXSFNFJTR-GIXUNCGXSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | 1.42 |
| Records Key | ['Lissoclinamide 2'] |
| Records Name | ['Lissoclinamide 2'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
