General Information of the Compound
| Compound ID |
CP0392119
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| Compound Name |
5-Chloro-2-methyl-3-(8-methyl-8-aza-bicyclo[3.2.1]oct-2-en-3-yl)-1H-indole
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| Structure |
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| Formula |
C17H19ClN2
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| Molecular Weight |
286.806
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| Canonical SMILES |
CN1C2CCC1C=C(C2)c1c(C)[nH]c2ccc(Cl)cc12
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| InChI |
InChI=1S/C17H19ClN2/c1-10-17(15-9-12(18)3-6-16(15)19-10)11-7-13-4-5-14(8-11)20(13)2/h3,6-7,9,13-14,19H,4-5,8H2,1-2H3
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| InChIKey |
MVLIQLIRDXPWKN-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