Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
LI5M7N
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| Ligand Name |
Shp2-IN-8
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| Synonyms |
SHP2-IN-8; CHEMBL4789106; 6-[4-(aminomethyl)-4-methyl-piperidin-1-yl]-3-[2,3-bis(chloranyl)phenyl]sulfanyl-pyrazin-2-amine; SCHEMBL16915558; BDBM50553786; HY-144396; CS-0380107; 83Q
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| Structure |
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Download2D MOL |
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| Formula |
C17H21Cl2N5S
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| Canonical SMILES |
CC1(CCN(CC1)C2=CN=C(C(=N2)N)SC3=C(C(=CC=C3)Cl)Cl)CN
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| InChI |
1S/C17H21Cl2N5S/c1-17(10-20)5-7-24(8-6-17)13-9-22-16(15(21)23-13)25-12-4-2-3-11(18)14(12)19/h2-4,9H,5-8,10,20H2,1H3,(H2,21,23)
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| InChIKey |
HFZSVNQUAOVFHI-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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