General Information of the Compound
| Compound ID |
CP0389918
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| Compound Name |
N-[(1-morpholin-4-ylcycloheptyl)methyl]-4-(3-quinolin-2-yl-1,2,4-oxadiazol-5-yl)piperidine-1-carboxamide
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| Structure |
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| Formula |
C29H38N6O3
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| Molecular Weight |
518.662
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| Canonical SMILES |
O=C(NCC1(CCCCCC1)N1CCOCC1)N1CCC(CC1)c1nc(no1)-c1ccc2ccccc2n1
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| InChI |
InChI=1S/C29H38N6O3/c36-28(30-21-29(13-5-1-2-6-14-29)35-17-19-37-20-18-35)34-15-11-23(12-16-34)27-32-26(33-38-27)25-10-9-22-7-3-4-8-24(22)31-25/h3-4,7-10,23H,1-2,5-6,11-21H2,(H,30,36)
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| InChIKey |
GHKXFKRCWJPUHM-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