compound 39 [PMID: 34982553]
SMILES | N[C@@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C/C=C\C1)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](C(=O)O)Cc1c2ccccc2ccc1 |
InChIKey | VXVNSDXGZQXERO-NXDMJTDOSA-N |
Chemical properties
Hydrogen bond acceptors | 13 |
Hydrogen bond donors | 14 |
Rotatable bonds | 21 |
Molecular weight (Da) | 1019.6 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |