General Information of the Compound
| Compound ID |
CP0634074
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| Compound Name |
2-(4-chlorophenylamino)-3-hydroxy-N-(6H-thiazolo[5,4-e]indazol-2-yl)propanamide
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| Structure |
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| Formula |
C17H14ClN5O2S
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| Molecular Weight |
387.852
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| Canonical SMILES |
O=C(Nc1nc2ccc3[nH]ncc3c2s1)C(CO)Nc1ccc(Cl)cc1
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| InChI |
InChI=1S/C17H14ClN5O2S/c18-9-1-3-10(4-2-9)20-14(8-24)16(25)22-17-21-13-6-5-12-11(7-19-23-12)15(13)26-17/h1-7,14,20,24H,8H2,(H,19,23)(H,21,22,25)
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| InChIKey |
PXKQKKHBHPRTEG-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