General Information of the Compound
| Compound ID |
CP0108364
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| Compound Name |
[4-[(3-cyclobutyl-1,2,4,5-tetrahydro-3-benzazepin-7-yl)oxy]piperidin-1-yl]-(5-methyl-1,2-oxazol-3-yl)methanone
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| Structure |
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| Formula |
C24H31N3O3
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| Molecular Weight |
409.53
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| Canonical SMILES |
Cc1cc(no1)C(=O)N1CCC(CC1)Oc1ccc2CCN(CCc2c1)C1CCC1
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| InChI |
InChI=1S/C24H31N3O3/c1-17-15-23(25-30-17)24(28)27-13-9-21(10-14-27)29-22-6-5-18-7-11-26(20-3-2-4-20)12-8-19(18)16-22/h5-6,15-16,20-21H,2-4,7-14H2,1H3
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| InChIKey |
MYAXDFIQUFKCGW-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