| Entry |
|
|---|
| Name |
Iniparib (USAN/INN) |
|---|
| Formula |
C7H5IN2O3
|
|---|
| Exact mass |
291.9345
|
|---|
| Mol weight |
292.0307
|
|---|
| Structure |
|
|---|
| Class |
Antineoplastic
DG02942 PARP inhibitor
|
|---|
| Efficacy |
Antineoplastic, PARP1 inhibitor |
|---|
| Target |
|
|---|
| Pathway |
|
|---|
| Brite |
Drug groups [BR:br08330]
Antineoplastic
DG02942 PARP inhibitor
D09913 Iniparib
Target-based classification of drugs [BR:br08310]
Enzymes
Transferases (EC2)
Pentosyltransferases
PARP1
D09913 Iniparib (USAN/INN)
|
|---|
| Other DBs |
|
|---|
| KCF data |
ATOM 13
1 C8y C 10.3600 -19.5300
2 C8x C 10.3600 -20.9300
3 C8x C 11.5724 -21.6300
4 C8y C 12.7849 -20.9300
5 C8x C 12.7849 -19.5300
6 C8y C 11.5724 -18.8300
7 N2b N 11.5724 -17.4302 #+
8 O3a O 10.3432 -16.7203
9 O3a O 12.9780 -16.3898 #-
10 X I 9.1476 -18.8300
11 C5a C 14.0160 -21.6410
12 O5a O 15.2212 -20.9453
13 N1a N 14.0157 -23.0299
BOND 13
1 1 2 1
2 2 3 2
3 3 4 1
4 4 5 2
5 5 6 1
6 1 6 2
7 6 7 1
8 7 8 2
9 7 9 1
10 1 10 1
11 4 11 1
12 11 12 2
13 11 13 1
|
|---|
