General Information of the Compound
| Compound ID |
CP0901931
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| Compound Name |
N-cyclohexyl-5-(quinolin-6-yl)benzo[d]oxazol-2-amine
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| Structure |
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| Formula |
C22H21N3O
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| Molecular Weight |
343.43
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| Canonical SMILES |
c1cnc2ccc(-c3ccc4oc(NC5CCCCC5)nc4c3)cc2c1
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| InChI |
InChI=1S/C22H21N3O/c1-2-6-18(7-3-1)24-22-25-20-14-16(9-11-21(20)26-22)15-8-10-19-17(13-15)5-4-12-23-19/h4-5,8-14,18H,1-3,6-7H2,(H,24,25)
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| InChIKey |
QEAMWHTZZRBLLX-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