General Information of the Compound
| Compound ID |
CP0530454
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| Compound Name |
2-(3-Chloro-phenyl)-4-propyl-morpholine
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| Structure |
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| Formula |
C13H18ClNO
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| Molecular Weight |
239.746
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| Canonical SMILES |
CCCN1CCOC(C1)c1cccc(Cl)c1
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| InChI |
InChI=1S/C13H18ClNO/c1-2-6-15-7-8-16-13(10-15)11-4-3-5-12(14)9-11/h3-5,9,13H,2,6-8,10H2,1H3
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| InChIKey |
BHSWGNCHNWRXBG-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