MMP SMILES
Table 1. SMILES added to Uncouplers of Oxidative Phosphorylation from Borton and Coleman paper.
|
Compound Name |
SMILES |
|
mitoFluo |
1(cc2c(cc1)c(c1c(o2)cc(=O)cc1)c1ccccc1C(=O)OCCCCCCCCCCP(c1ccccc1)(c1ccccc1)c1ccccc1)O |
|
Bromethalin |
CN(c1c(cc(cc1[N+](=O)[O-])[N+](=O)[O-])C(F)(F)F)c1c(cc(cc1Br)Br)Br |
|
CCCP |
c1cc(cc(c1)Cl)NN=C(C#N)C#N |
|
FCCP |
c1cc(ccc1NN=C(C#N)C#N)OC(F)(F)F |
|
CCP |
c1ccc(cc1)NN=C(C#N)C#N |
|
2_4-DNP |
c1cc(c(cc1[N+](=O)[O-])[N+](=O)[O-])O |
|
DNOC |
Cc1cc(cc(c1O)[N+](=O)[O-])[N+](=O)[O-] |
|
Dinoseb |
CCC(C)c1c(c(cc(c1)[N+](=O)[O-])[N+](=O)[O-])O |
|
Dinoterb |
CC(C)(C)c1c(c(cc(c1)[N+](=O)[O-])[N+](=O)[O-])O |
|
PCP |
c1(c(c(c(c(c1Cl)Cl)Cl)Cl)Cl)O |
|
S-13 |
CC(C)(C)c1cc(cc(c1O)C(=O)Nc1c(cc(cc1)[N+](=O)[O-])Cl)Cl |
|
SF_6847 |
CC(C)(C)c1cc(cc(c1O)C(C)(C)C)C=C(C#N)C#N |
|
Dicoumarol |
c1ccc2c(c1)c(c(c(=O)o2)Cc1c(c2ccccc2oc1=O)O)O |
|
Ellipticine |
Cc1c2ccncc2c(c2c1[nH]c1ccccc21)C |
|
Niclosamide |
c1cc(c(cc1[N+](=O)[O-])Cl)NC(=O)c1c(ccc(c1)Cl)O |
|
Oxyclozanide |
c1c(cc(c(c1NC(=O)c1c(c(cc(c1Cl)Cl)Cl)O)O)Cl)Cl |
|
FR58P1a |
C[C@H]1C=CC(c2c1c(c1C(=O)C=CC(c1c2O)(C)C)O)COC(=O)CCCCCBr |
|
FH535 |
Cc1c(ccc(c1)[N+](=O)[O-])NS(=O)(=O)c1c(ccc(c1)Cl)Cl |
|
F16 |
C[n+]1ccc(cc1)/C=C/c1c[nH]c2ccccc12.[I-] |
|
5BMF |
Cc1cc(cc2c1[nH]cc2/C=C/c1cc[n+](cc1)C)Br |