General Information of the Compound
| Compound ID |
CP0635787
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| Compound Name |
methyl 5-(1-(6H-thiazolo[5,4-e]indazol-2-ylamino)-2-methyl-1-oxopropan-2-ylamino)-2-chlorophenylcarbamate
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| Structure |
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| Formula |
C20H19ClN6O3S
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| Molecular Weight |
458.931
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| Canonical SMILES |
COC(=O)Nc1cc(NC(C)(C)C(=O)Nc2nc3ccc4[nH]ncc4c3s2)ccc1Cl
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| InChI |
InChI=1S/C20H19ClN6O3S/c1-20(2,26-10-4-5-12(21)15(8-10)24-19(29)30-3)17(28)25-18-23-14-7-6-13-11(9-22-27-13)16(14)31-18/h4-9,26H,1-3H3,(H,22,27)(H,24,29)(H,23,25,28)
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| InChIKey |
RUXYNOSALJFQEA-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