Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
L3AH9S
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| Ligand Name |
cyclooctyl N-[3-[[4-[5-[[(3R)-1-[2-oxo-2-[4-(4-pyrimidin-2-ylphenyl)piperazin-1-yl]ethyl]pyrrolidine-3-carbonyl]amino]-1H-indazol-3-yl]pyridine-2-carbonyl]amino]propyl]carbamate
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| Structure |
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Download2D MOL
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| Formula |
C46H55N11O5
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| Canonical SMILES |
C1CCCC(CCC1)OC(=O)NCCCNC(=O)C2=NC=CC(=C2)C3=NNC4=C3C=C(C=C4)NC(=O)C5CCN(C5)CC(=O)N6CCN(CC6)C7=CC=C(C=C7)C8=NC=CC=N8
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| InChI |
1S/C46H55N11O5/c58-41(57-26-24-56(25-27-57)36-13-10-32(11-14-36)43-48-18-6-19-49-43)31-55-23-17-34(30-55)44(59)52-35-12-15-39-38(29-35)42(54-53-39)33-16-22-47-40(28-33)45(60)50-20-7-21-51-46(61)62-37-8-4-2-1-3-5-9-37/h6,10-16,18-19,22,28-29,34,37H,1-5,7-9,17,20-21,23-27,30-31H2,(H,50,60)(H,51,61)(H,52,59)(H,53,54)/t34-/m1/s1
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| InChIKey |
FWLOTDDRDKLCPO-UUWRZZSWSA-N
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| PubChem Compound ID | ||||
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