Entry |
|
Name |
Indoximod (USAN/INN) |
Formula |
C12H14N2O2
|
Exact mass |
218.1055
|
Mol weight |
218.25
|
Structure |

|
Simcomp |
|
Efficacy |
Antineoplastic |
Target |
|
Pathway |
|
Brite |
Target-based classification of drugs [BR:br08310]
Enzymes
Oxidoreductases (EC1)
Dioxygenases
IDO
D10640 Indoximod (USAN/INN)
|
Other DBs |
|
LinkDB |
|
KCF data |
ATOM 16
1 C8y C 17.0306 -15.4043
2 C8y C 18.3668 -15.6856
3 C8y C 16.3274 -16.5999
4 C8x C 16.3274 -14.1384
5 C1b C 19.4217 -14.8417
6 C8x C 18.4372 -17.0921
7 N4y N 17.1713 -17.6548
8 C8x C 14.8505 -16.5999
9 C8x C 14.9208 -14.1384
10 C1c C 20.6876 -15.4746
11 C8x C 14.1472 -15.4043
12 C6a C 21.8832 -14.8417
13 O6a O 23.0787 -15.5450
14 O6a O 21.8832 -13.4352
15 C1a C 16.8897 -18.9910
16 N1a N 20.6876 -16.8812
BOND 17
1 1 2 1
2 1 3 2
3 1 4 1
4 2 5 1
5 2 6 2
6 3 7 1
7 3 8 1
8 4 9 2
9 5 10 1
10 8 11 2
11 10 12 1
12 12 13 1
13 12 14 2
14 6 7 1
15 9 11 1
16 7 15 1
17 10 16 1 #Down
|