General Information of the Compound
| Compound ID |
CP0428969
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| Compound Name |
(9-heptylcarbazol-3-yl)-piperidin-1-ylmethanone
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| Structure |
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| Formula |
C25H32N2O
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| Molecular Weight |
376.544
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| Canonical SMILES |
CCCCCCCn1c2ccccc2c2cc(ccc12)C(=O)N1CCCCC1
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| InChI |
InChI=1S/C25H32N2O/c1-2-3-4-5-11-18-27-23-13-8-7-12-21(23)22-19-20(14-15-24(22)27)25(28)26-16-9-6-10-17-26/h7-8,12-15,19H,2-6,9-11,16-18H2,1H3
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| InChIKey |
XEHAWLSJADOIFP-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