General Information of the Compound
| Compound ID |
CP0338372
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| Compound Name |
3-(1-cycloheptylindazol-5-yl)-2,2-dimethyl-3-phenyl-N-(1,3,4-thiadiazol-2-yl)propanamide
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| Structure |
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| Formula |
C27H31N5OS
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| Molecular Weight |
473.646
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| Canonical SMILES |
CC(C)(C(c1ccccc1)c1ccc2n(ncc2c1)C1CCCCCC1)C(=O)Nc1nncs1
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| InChI |
InChI=1S/C27H31N5OS/c1-27(2,25(33)30-26-31-28-18-34-26)24(19-10-6-5-7-11-19)20-14-15-23-21(16-20)17-29-32(23)22-12-8-3-4-9-13-22/h5-7,10-11,14-18,22,24H,3-4,8-9,12-13H2,1-2H3,(H,30,31,33)
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| InChIKey |
WIRCDWBPRJBJPE-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