General Information of the Compound
| Compound ID |
CP0553962
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| Compound Name |
1-(azetidin-1-yl)-3-(3,4-dihydro-2H-quinolin-1-yl)propan-1-one
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| Formula |
C15H20N2O
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| Molecular Weight |
244.338
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| Canonical SMILES |
O=C(CCN1CCCc2ccccc12)N1CCC1
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| InChI |
InChI=1S/C15H20N2O/c18-15(17-10-4-11-17)8-12-16-9-3-6-13-5-1-2-7-14(13)16/h1-2,5,7H,3-4,6,8-12H2
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| InChIKey |
VDGCBKQFUSCJOT-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