General Information of the Compound
| Compound ID |
CP0564184
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| Compound Name |
(Z)-1-(1H-benzimidazol-2-yl)octadec-9-en-1-one
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| Structure |
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| Formula |
C25H38N2O
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| Molecular Weight |
382.592
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| Canonical SMILES |
CCCCCCCC\C=C/CCCCCCCC(=O)c1nc2ccccc2[nH]1
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| InChI |
InChI=1S/C25H38N2O/c1-2-3-4-5-6-7-8-9-10-11-12-13-14-15-16-21-24(28)25-26-22-19-17-18-20-23(22)27-25/h9-10,17-20H,2-8,11-16,21H2,1H3,(H,26,27)/b10-9-
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| InChIKey |
VKPDHLJPWCXWCW-KTKRTIGZSA-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