General Information of the Compound
| Compound ID |
CP0182036
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| Compound Name |
(7-Chloro-quinolin-4-yl)-(12-piperidin-1-yl-dodecyl)-amine; Oxalic acid
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| Structure |
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| Formula |
C26H40ClN3
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| Molecular Weight |
430.08
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| Canonical SMILES |
Clc1ccc2c(NCCCCCCCCCCCCN3CCCCC3)ccnc2c1
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| InChI |
InChI=1S/C26H40ClN3/c27-23-14-15-24-25(16-18-29-26(24)22-23)28-17-10-7-5-3-1-2-4-6-8-11-19-30-20-12-9-13-21-30/h14-16,18,22H,1-13,17,19-21H2,(H,28,29)
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| InChIKey |
CTBQWSSPGINCLL-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