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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