General Information of the Compound
| Compound ID |
CP0571354
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| Compound Name |
7-N,7-N-dipropyl-2-N-(2,4,6-trimethylphenyl)-1,3-benzothiazole-2,7-diamine
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| Structure |
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| Formula |
C22H29N3S
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| Molecular Weight |
367.562
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| Canonical SMILES |
CCCN(CCC)c1cccc2nc(Nc3c(C)cc(C)cc3C)sc12
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| InChI |
InChI=1S/C22H29N3S/c1-6-11-25(12-7-2)19-10-8-9-18-21(19)26-22(23-18)24-20-16(4)13-15(3)14-17(20)5/h8-10,13-14H,6-7,11-12H2,1-5H3,(H,23,24)
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| InChIKey |
NZLAOXKEMLYLIA-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