General Information of the Compound
| Compound ID |
CP0534137
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| Compound Name |
9-[3-(1H-benzimidazol-2-yl)propyl]-5,6,7,8-tetrahydrocarbazole-3-carbonitrile
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| Structure |
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| Formula |
C23H22N4
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| Molecular Weight |
354.457
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| Canonical SMILES |
N#Cc1ccc2n(CCCc3nc4ccccc4[nH]3)c3CCCCc3c2c1
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| InChI |
InChI=1S/C23H22N4/c24-15-16-11-12-22-18(14-16)17-6-1-4-9-21(17)27(22)13-5-10-23-25-19-7-2-3-8-20(19)26-23/h2-3,7-8,11-12,14H,1,4-6,9-10,13H2,(H,25,26)
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| InChIKey |
INZZLTCMGWYMQT-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