General Information of the Compound
| Compound ID |
CP0368731
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| Compound Name |
(1S,2S)-2-phenyl-N-(6-pyridin-4-yl-1,3-benzothiazol-2-yl)cyclopropane-1-carboxamide
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| Structure |
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| Formula |
C22H17N3OS
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| Molecular Weight |
371.465
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| Canonical SMILES |
O=C(Nc1nc2ccc(cc2s1)-c1ccncc1)[C@H]1C[C@@H]1c1ccccc1
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| InChI |
InChI=1S/C22H17N3OS/c26-21(18-13-17(18)15-4-2-1-3-5-15)25-22-24-19-7-6-16(12-20(19)27-22)14-8-10-23-11-9-14/h1-12,17-18H,13H2,(H,24,25,26)/t17-,18+/m1/s1
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| InChIKey |
WCIQHQDDKIZJND-MSOLQXFVSA-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