General Information of the Compound
| Compound ID |
CP0248934
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| Compound Name |
3-benzyl-8-chloro-2H-pyrazino[1,2-a]indol-1-one
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| Structure |
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| Formula |
C18H13ClN2O
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| Molecular Weight |
308.768
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| Canonical SMILES |
Clc1ccc2c(cc3n2cc(Cc2ccccc2)[nH]c3=O)c1
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| InChI |
InChI=1S/C18H13ClN2O/c19-14-6-7-16-13(9-14)10-17-18(22)20-15(11-21(16)17)8-12-4-2-1-3-5-12/h1-7,9-11H,8H2,(H,20,22)
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| InChIKey |
XQWJECIZRPTKDQ-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