General Information of the Compound
| Compound ID |
CP0505240
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| Compound Name |
N-[1-[(3,5-dimethoxyphenyl)methyl]piperidin-3-yl]-1H-indazol-5-amine
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| Structure |
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| Formula |
C21H26N4O2
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| Molecular Weight |
366.465
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| Canonical SMILES |
COc1cc(CN2CCCC(C2)Nc2ccc3[nH]ncc3c2)cc(OC)c1
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| InChI |
InChI=1S/C21H26N4O2/c1-26-19-8-15(9-20(11-19)27-2)13-25-7-3-4-18(14-25)23-17-5-6-21-16(10-17)12-22-24-21/h5-6,8-12,18,23H,3-4,7,13-14H2,1-2H3,(H,22,24)
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| InChIKey |
QRVGBTGBMIUBQJ-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