General Information of the Compound
| Compound ID |
CP0297470
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| Compound Name |
4-(6,7-Dihydro-5H-benzo[6,7]cyclohepta[1,2-d]pyrimidin-2-ylamino)-benzenesulfonamide
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| Structure |
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| Formula |
C19H18N4O2S
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| Molecular Weight |
366.446
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| Canonical SMILES |
NS(=O)(=O)c1ccc(Nc2ncc3CCCc4ccccc4-c3n2)cc1
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| InChI |
InChI=1S/C19H18N4O2S/c20-26(24,25)16-10-8-15(9-11-16)22-19-21-12-14-6-3-5-13-4-1-2-7-17(13)18(14)23-19/h1-2,4,7-12H,3,5-6H2,(H2,20,24,25)(H,21,22,23)
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| InChIKey |
VPVXBWMLSPOFOK-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