General Information of the Compound
| Compound ID |
CP0570965
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| Compound Name |
N-[2-[2-(5-methoxy-1H-indol-3-yl)ethylcarbamoyl]phenyl]-1,2-benzothiazole-3-carboxamide
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| Structure |
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| Formula |
C26H22N4O3S
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| Molecular Weight |
470.554
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| Canonical SMILES |
COc1ccc2[nH]cc(CCNC(=O)c3ccccc3NC(=O)c3nsc4ccccc34)c2c1
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| InChI |
InChI=1S/C26H22N4O3S/c1-33-17-10-11-21-20(14-17)16(15-28-21)12-13-27-25(31)18-6-2-4-8-22(18)29-26(32)24-19-7-3-5-9-23(19)34-30-24/h2-11,14-15,28H,12-13H2,1H3,(H,27,31)(H,29,32)
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| InChIKey |
PHJRKAVKJCTJMS-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