General Information of the Compound
| Compound ID |
CP0571831
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| Compound Name |
2-(1-butan-2-yl-5-methoxyindol-3-yl)-3-chloroquinoxaline
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| Structure |
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| Formula |
C21H20ClN3O
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| Molecular Weight |
365.864
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| Canonical SMILES |
CCC(C)n1cc(-c2nc3ccccc3nc2Cl)c2cc(OC)ccc12
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| InChI |
InChI=1S/C21H20ClN3O/c1-4-13(2)25-12-16(15-11-14(26-3)9-10-19(15)25)20-21(22)24-18-8-6-5-7-17(18)23-20/h5-13H,4H2,1-3H3
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| InChIKey |
GNOGKKCNXRDYFI-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