General Information of the Compound
| Compound ID |
CP0518942
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| Compound Name |
(+/-)-N-(4-(4-butyl-4,5-dihydrothiazol-2-ylamino)phenethyl)benzo[d]thiazol-2-amine
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| Structure |
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| Formula |
C22H26N4S2
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| Molecular Weight |
410.612
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| Canonical SMILES |
CCCCC1CSC(N1)=Nc1ccc(CCNc2nc3ccccc3s2)cc1
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| InChI |
InChI=1S/C22H26N4S2/c1-2-3-6-18-15-27-22(25-18)24-17-11-9-16(10-12-17)13-14-23-21-26-19-7-4-5-8-20(19)28-21/h4-5,7-12,18H,2-3,6,13-15H2,1H3,(H,23,26)(H,24,25)
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| InChIKey |
LZMKZXBLUSHGGU-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