General Information of the Compound
| Compound ID |
CP0522892
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| Compound Name |
(+/-)-N-(4-(4-(3-chlorophenyl)-5,6-dihydro-4H-1,3-thiazin-2-ylamino)phenethyl)benzo[d]thiazol-2-amine
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| Structure |
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| Formula |
C25H23ClN4S2
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| Molecular Weight |
479.074
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| Canonical SMILES |
Clc1cccc(c1)C1CCSC(N1)=Nc1ccc(CCNc2nc3ccccc3s2)cc1
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| InChI |
InChI=1S/C25H23ClN4S2/c26-19-5-3-4-18(16-19)21-13-15-31-25(29-21)28-20-10-8-17(9-11-20)12-14-27-24-30-22-6-1-2-7-23(22)32-24/h1-11,16,21H,12-15H2,(H,27,30)(H,28,29)
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| InChIKey |
VXFZXSPHKOMCCL-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