General Information of the Compound
| Compound ID |
CP0542932
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| Compound Name |
1-benzyl-4-piperidyl-(1H-5-indazolyl)ether
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| Structure |
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| Formula |
C19H21N3O
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| Molecular Weight |
307.397
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| Canonical SMILES |
C(N1CCC(CC1)Oc1ccc2[nH]ncc2c1)c1ccccc1
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| InChI |
InChI=1S/C19H21N3O/c1-2-4-15(5-3-1)14-22-10-8-17(9-11-22)23-18-6-7-19-16(12-18)13-20-21-19/h1-7,12-13,17H,8-11,14H2,(H,20,21)
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| InChIKey |
KISRNCQKDLQJQN-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