General Information of the Compound
| Compound ID |
CP0490453
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| Compound Name |
6-Chloro-1,2,3,4,8,9,10,11-octahydro-[1,4]diazepino[6,7,1-jk]carbazole
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| Structure |
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| Formula |
C15H17ClN2
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| Molecular Weight |
260.768
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| Canonical SMILES |
Clc1cc2CNCCn3c4CCCCc4c(c1)c23
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| InChI |
InChI=1S/C15H17ClN2/c16-11-7-10-9-17-5-6-18-14-4-2-1-3-12(14)13(8-11)15(10)18/h7-8,17H,1-6,9H2
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| InChIKey |
AREHGEYQVHAQLN-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