General Information of the Compound
| Compound ID |
CP0482370
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| Compound Name |
8-fluoro-2-piperidin-1-ylindolo[2,1-b]quinazoline-6,12-dione
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| Structure |
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| Formula |
C20H16FN3O2
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| Molecular Weight |
349.365
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| Canonical SMILES |
Fc1ccc-2c(c1)C(=O)c1nc3ccc(cc3c(=O)n-21)N1CCCCC1
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| InChI |
InChI=1S/C20H16FN3O2/c21-12-4-7-17-15(10-12)18(25)19-22-16-6-5-13(23-8-2-1-3-9-23)11-14(16)20(26)24(17)19/h4-7,10-11H,1-3,8-9H2
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| InChIKey |
DCMJYRYVAMKYLN-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
Protein ID: PT01557, Indoleamine 2,3-dioxygenase 1
Protein ID: PT03341, Indoleamine 2,3-dioxygenase 2
Protein ID: PT02896, Tryptophan 2,3-dioxygenase