General Information of the Compound
| Compound ID |
CP0509941
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| Compound Name |
6-chloro-2a-[4-(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)butyl]-1,3,4,5-tetrahydrobenzo[cd]indol-2-one
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| Structure |
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| Formula |
C26H29ClN2O
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| Molecular Weight |
420.984
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| Canonical SMILES |
Clc1ccc2NC(=O)C3(CCCCN4CCC(=CC4)c4ccccc4)CCCc1c23
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| InChI |
InChI=1S/C26H29ClN2O/c27-22-10-11-23-24-21(22)9-6-15-26(24,25(30)28-23)14-4-5-16-29-17-12-20(13-18-29)19-7-2-1-3-8-19/h1-3,7-8,10-12H,4-6,9,13-18H2,(H,28,30)
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| InChIKey |
WOSIIVLLLDDXJL-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound