General Information of the Compound
| Compound ID |
CP0480325
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| Compound Name |
6-phenoxy-3,4-dihydro-2H-pyrido[3,4-b]indol-1(9H)-one
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| Structure |
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| Formula |
C17H14N2O2
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| Molecular Weight |
278.311
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| Canonical SMILES |
O=C1NCCc2c1[nH]c1ccc(Oc3ccccc3)cc21
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| InChI |
InChI=1S/C17H14N2O2/c20-17-16-13(8-9-18-17)14-10-12(6-7-15(14)19-16)21-11-4-2-1-3-5-11/h1-7,10,19H,8-9H2,(H,18,20)
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| InChIKey |
UOPKEEZQJMHBKN-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