General Information of the Compound
| Compound ID |
CP0109570
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| Compound Name |
2-(1,4'-bipiperidin-1'-yl)-5-(3-chloro-5-methoxyphenyl)-1,3,4-thiadiazole
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| Structure |
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| Formula |
C19H25ClN4OS
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| Molecular Weight |
392.956
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| Canonical SMILES |
COc1cc(Cl)cc(c1)-c1nnc(s1)N1CCC(CC1)N1CCCCC1
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| InChI |
InChI=1S/C19H25ClN4OS/c1-25-17-12-14(11-15(20)13-17)18-21-22-19(26-18)24-9-5-16(6-10-24)23-7-3-2-4-8-23/h11-13,16H,2-10H2,1H3
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| InChIKey |
AJIVZQVIMWGUQU-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