General Information of the Compound
| Compound ID |
CP0296591
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| Compound Name |
4-(3-phenyl-1,2,4-thiadiazol-5-yl)-N-pyridazin-3-ylpiperazine-1-carboxamide
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| Structure |
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| Formula |
C17H17N7OS
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| Molecular Weight |
367.438
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| Canonical SMILES |
O=C(Nc1cccnn1)N1CCN(CC1)c1nc(ns1)-c1ccccc1
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| InChI |
InChI=1S/C17H17N7OS/c25-16(19-14-7-4-8-18-21-14)23-9-11-24(12-10-23)17-20-15(22-26-17)13-5-2-1-3-6-13/h1-8H,9-12H2,(H,19,21,25)
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| InChIKey |
ZYZILSQXANZBSQ-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