General Information of the Compound
| Compound ID |
CP0152206
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| Compound Name |
[3-[(4-chlorophenyl)-(2-chloropyridin-3-yl)methoxy]azetidin-1-yl]-pyrrolidin-1-ylmethanone
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| Structure |
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| Formula |
C20H21Cl2N3O2
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| Molecular Weight |
406.313
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| Canonical SMILES |
Clc1ccc(cc1)C(OC1CN(C1)C(=O)N1CCCC1)c1cccnc1Cl
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| InChI |
InChI=1S/C20H21Cl2N3O2/c21-15-7-5-14(6-8-15)18(17-4-3-9-23-19(17)22)27-16-12-25(13-16)20(26)24-10-1-2-11-24/h3-9,16,18H,1-2,10-13H2
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| InChIKey |
CIAIGDUPLJRKJZ-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