General Information of the Compound
| Compound ID |
CP0578389
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| Compound Name |
2-[4,7-dichloro-6-(4-morpholin-4-ylphenyl)indazol-2-yl]-2-(6,7-dihydro-5H-pyrrolo[1,2-c]imidazol-1-yl)-N-(1,3-thiazol-2-yl)acetamide
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| Structure |
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| Formula |
C28H25Cl2N7O2S
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| Molecular Weight |
594.528
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| Canonical SMILES |
Clc1cc(-c2ccc(cc2)N2CCOCC2)c(Cl)c2nn(cc12)C(C(=O)Nc1nccs1)c1ncn2CCCc12
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| InChI |
InChI=1S/C28H25Cl2N7O2S/c29-21-14-19(17-3-5-18(6-4-17)35-9-11-39-12-10-35)23(30)24-20(21)15-37(34-24)26(27(38)33-28-31-7-13-40-28)25-22-2-1-8-36(22)16-32-25/h3-7,13-16,26H,1-2,8-12H2,(H,31,33,38)
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| InChIKey |
NKMGCTJBEBJYHO-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