General Information of the Compound
| Compound ID |
CP0115062
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| Compound Name |
8-nitroindolo[2,1-b]quinazoline-6,12-dione
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| Synonyms |
77603-42-0
8-Nitrotryptanthrin
AC1L9YX7
AKOS032945018
BCP26220
BDBM50442991
CS-6001
CTK5I3547
GNF-PF-3777
GTPL10126
GTPL8223
HY-100687
Oprea1_383200
Oprea1_416302
PMID24099220C5i
ZINC334588
tryptanthrin 5i
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| Structure |
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| Formula |
C15H7N3O4
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| Molecular Weight |
293.238
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| Canonical SMILES |
[O-][N+](=O)c1ccc-2c(c1)C(=O)c1nc3ccccc3c(=O)n-21
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| InChI |
InChI=1S/C15H7N3O4/c19-13-10-7-8(18(21)22)5-6-12(10)17-14(13)16-11-4-2-1-3-9(11)15(17)20/h1-7H
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| InChIKey |
UFMQJYHLIUACCG-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
Clinical Information about the Compound