Detailed description page of DenvInD
This page provides detail information of Selected ID DenvInD_168 |
| Primary information | |
|---|---|
| ID | DenvInD_168 |
| IUPAC | 3-[(1R,4S,7S,13S,16S,19S,22S,25R,31S,37S,40S,45R,51S,54S,57S,60S,63S,66S,72R,75S,78S,84S,90S,93S,96S)-40-amino-19,22,51,54,90,93-hexakis(3-carbamimidamidopropyl)-63-(2-carboxyethyl)-37,96-bis[(1R)-1-hydroxyethyl]-16,57,66-tris(hydroxymethyl)-13-(1H-indol-3-ylmethyl)-84-(2-methylpropyl)-3,6,12,15,18,21,24,27,30,36,39,42,44,47,50,53,56,59,62,65,68,71,74,77,83,86,89,92,95,98-triacontaoxo-4,75-di(propan-2-yl)-a,1a,4a,5a-tetrathia-2,5,11,14,17,20,23,26,29,35,38,43,46,49,52,55,58,61,64,67,70,73,76,82,85,88,91,94,97-nonacosazahexacyclo[70.26.4.425,45.07,11.031,35.078,82]hexahectan-60-yl]propanoic acid |
| CID | 46231133 |
| SID | 103726337 |
| AID | 460481 |
| SMILES | CC(C)CC1C(=O)N2CCCC2C(=O)NC(C(=O)NC3CSSCC(C(=O)NC(C(=O)NC(C(=O)NC(C(=O)NCC(=O)N1)CCCNC(=N)N)CCCNC(=N)N)C(C)O)NC(=O)C(NC(=O)C4CCCN4C(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C5CSSCC(C(=O)NC(=O)CC(C(=O)NC(C(=O)N6CCCC6C(=O)NCC(=O)N5)C(C)O)N)NC(=O)CNC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)C(NC(=O)CNC3=O)CO)CCC(=O)O)CCC(=O)O)CO)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N)CCCNC(=N)N)CO)CC7=CNC8=CC=CC=C87)C(C)C)C(C)C |
| IC50 | NA |
| Ki | 3.03 |
| EC50 | NA |
| CC50 | NA |
| PMID | 20042339 |
| Protein Name | NS3 Protease |