General Information of the Compound
| Compound ID |
CP0084998
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| Compound Name |
3-(propylaminomethyl)chromen-2-one
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| Structure |
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| Formula |
C13H15NO2
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| Molecular Weight |
217.268
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| Canonical SMILES |
CCCNCc1cc2ccccc2oc1=O
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| InChI |
InChI=1S/C13H15NO2/c1-2-7-14-9-11-8-10-5-3-4-6-12(10)16-13(11)15/h3-6,8,14H,2,7,9H2,1H3
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| InChIKey |
CJBPGDPRUYWCPW-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