General Information of the Compound
| Compound ID |
CP0152203
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| Compound Name |
[3-[(2-chloropyridin-3-yl)-(4-fluorophenyl)methoxy]azetidin-1-yl]-piperidin-1-ylmethanone
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| Structure |
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| Formula |
C21H23ClFN3O2
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| Molecular Weight |
403.885
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| Canonical SMILES |
Fc1ccc(cc1)C(OC1CN(C1)C(=O)N1CCCCC1)c1cccnc1Cl
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| InChI |
InChI=1S/C21H23ClFN3O2/c22-20-18(5-4-10-24-20)19(15-6-8-16(23)9-7-15)28-17-13-26(14-17)21(27)25-11-2-1-3-12-25/h4-10,17,19H,1-3,11-14H2
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| InChIKey |
MAPMANCRSZAYIX-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