Ligand Information
| Ligand General Information | Top | |||
|---|---|---|---|---|
| Ligand ID |
LG7WF3
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| Ligand Name |
N-[2-[2-(dimethylamino)ethoxy]-5-[4-[4-[(1,3-dioxoisoindol-2-yl)methyl]anilino]-7H-pyrrolo[2,3-d]pyrimidin-5-yl]phenyl]propanamide
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| Structure |
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Download2D MOL |
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| Formula |
C34H33N7O4
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| Canonical SMILES |
CCC(=O)NC1=C(C=CC(=C1)C2=CNC3=C2C(=NC=N3)NC4=CC=C(C=C4)CN5C(=O)C6=CC=CC=C6C5=O)OCCN(C)C
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| InChI |
1S/C34H33N7O4/c1-4-29(42)39-27-17-22(11-14-28(27)45-16-15-40(2)3)26-18-35-31-30(26)32(37-20-36-31)38-23-12-9-21(10-13-23)19-41-33(43)24-7-5-6-8-25(24)34(41)44/h5-14,17-18,20H,4,15-16,19H2,1-3H3,(H,39,42)(H2,35,36,37,38)
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| InChIKey |
AAWACOFFDRTXNP-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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