General Information of the Compound
| Compound ID |
CP0526288
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| Compound Name |
4-(1H-benzimidazol-2-yl)-N-(1,2,3,4-tetrahydronaphthalen-1-yl)-1-piperazinehexanamide
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| Structure |
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| Formula |
C27H35N5O
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| Molecular Weight |
445.611
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| Canonical SMILES |
O=C(CCCCCN1CCN(CC1)c1nc2ccccc2[nH]1)NC1CCCc2ccccc12
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| InChI |
InChI=1S/C27H35N5O/c33-26(28-23-14-8-10-21-9-3-4-11-22(21)23)15-2-1-7-16-31-17-19-32(20-18-31)27-29-24-12-5-6-13-25(24)30-27/h3-6,9,11-13,23H,1-2,7-8,10,14-20H2,(H,28,33)(H,29,30)
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| InChIKey |
XJDKGSGTCUENMS-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