Binder Information
| Binder General Information | Top | |||
|---|---|---|---|---|
| Binder ID |
BT1H3W
|
|||
| Binder Name |
Methyl (2S)-2-[[(2S)-6-(1-azabicyclo[2.2.2]octan-3-ylamino)-2-[[(2S)-2-[[(2S)-2-[[(2S)-2-[(2-benzamidoacetyl)amino]-3-phenylpropanoyl]amino]propanoyl]amino]-4-methylpentanoyl]amino]hexanoyl]amino]-3-hydroxypropanoate
|
|||
| Synonyms |
CHEMBL3908012; BDBM50194254
Click to Show/Hide
|
|||
| Binder Type |
Small molecular drug
|
|||
| Structure |
 |
Download2D MOL
|
||
| Formula |
C44H64N8O9
|
|||
| Canonical SMILES |
C[C@@H](C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCCNC1CN2CCC1CC2)C(=O)N[C@@H](CO)C(=O)OC)NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)CNC(=O)C4=CC=CC=C4
|
|||
| InChI |
1S/C44H64N8O9/c1-28(2)23-34(43(59)49-33(41(57)51-37(27-53)44(60)61-4)17-11-12-20-45-36-26-52-21-18-31(36)19-22-52)50-39(55)29(3)47-42(58)35(24-30-13-7-5-8-14-30)48-38(54)25-46-40(56)32-15-9-6-10-16-32/h5-10,13-16,28-29,31,33-37,45,53H,11-12,17-27H2,1-4H3,(H,46,56)(H,47,58)(H,48,54)(H,49,59)(H,50,55)(H,51,57)/t29-,33-,34-,35-,36?,37-/m0/s1
|
|||
| InChIKey |
DFYGXOYGRGSTSI-JQVWEZKJSA-N
|
|||
| PubChem Compound ID | ||||
If You Find Any Error in Data or Bug in Web Service, Please Kindly Report It to Dr. Zhou and Dr. Zhang.