Ligand Information
| Ligand General Information | Top | |||
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| Ligand ID |
L7Z0JV
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| Ligand Name |
Mcl1-IN-9
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| Synonyms |
Mcl1-IN-9; CHEMBL4094135; 3-({11-[3-(4-chloro-3,5-dimethylphenoxy)propyl]-1-oxo-7-(1,3,5-trimethyl-1H-pyrazol-4-yl)-4,5-dihydro-1H-[1,4]diazepino[1,2-a]indol-2(3H)-yl}methyl)benzoic acid; SCHEMBL17127797; BDBM50244141; HY-128607; CS-0096112; ECY
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| Structure |
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Download2D MOL |
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| Formula |
C37H39ClN4O4
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| Canonical SMILES |
CC1=CC(=CC(=C1Cl)C)OCCCC2=C3C(=O)N(CCCN3C4=C2C=CC=C4C5=C(N(N=C5C)C)C)CC6=CC(=CC=C6)C(=O)O
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| InChI |
1S/C37H39ClN4O4/c1-22-18-28(19-23(2)33(22)38)46-17-8-14-30-29-12-7-13-31(32-24(3)39-40(5)25(32)4)34(29)42-16-9-15-41(36(43)35(30)42)21-26-10-6-11-27(20-26)37(44)45/h6-7,10-13,18-20H,8-9,14-17,21H2,1-5H3,(H,44,45)
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| InChIKey |
VMBSCFPYXBSHSU-UHFFFAOYSA-N
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| PubChem Compound ID | ||||
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