General Information of the Compound
| Compound ID |
CP0203451
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| Compound Name |
N-[(2R)-1-[4-(4-methoxy-1,2,5-thiadiazol-3-yl)piperazin-1-yl]-3-phenylpropan-2-yl]-N-methylcyclohexanecarboxamide
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| Structure |
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| Formula |
C24H35N5O2S
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| Molecular Weight |
457.644
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| Canonical SMILES |
COc1nsnc1N1CCN(C[C@@H](Cc2ccccc2)N(C)C(=O)C2CCCCC2)CC1
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| InChI |
InChI=1S/C24H35N5O2S/c1-27(24(30)20-11-7-4-8-12-20)21(17-19-9-5-3-6-10-19)18-28-13-15-29(16-14-28)22-23(31-2)26-32-25-22/h3,5-6,9-10,20-21H,4,7-8,11-18H2,1-2H3/t21-/m1/s1
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| InChIKey |
ZGIKOSDGSCVIGR-OAQYLSRUSA-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