General Information of the Compound
| Compound ID |
CP0817704
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| Compound Name |
3-cyclohexyl-N-(5,6-dihydrothiazolo[2,3-c][1,2,4]triazol-3-yl)propanamide
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| Structure |
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| Formula |
C13H20N4OS
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| Molecular Weight |
280.397
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| Canonical SMILES |
O=C(CCC1CCCCC1)Nc1nnc2n1CCS2
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| InChI |
InChI=1S/C13H20N4OS/c18-11(7-6-10-4-2-1-3-5-10)14-12-15-16-13-17(12)8-9-19-13/h10H,1-9H2,(H,14,15,18)
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| InChIKey |
UVPFWJCKEJKCCW-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
Protein ID: PT02202, Poly [ADP-ribose] polymerase tankyrase-1
Protein ID: PT01425, Poly [ADP-ribose] polymerase tankyrase-2