SMILES for Dihydrolipoyl dehydrogenase

141 SMILES Strings for Dihydrolipoyl dehydrogenase

Compound Name

SMILES String

BDBM119884

Brc1ccc(NC(=O)C2CCC(CC2)S(=O)(=O)c2cccnc2)cc1 |(10.51,-3.79,;12.05,-3.79,;12.82,-2.46,;14.36,-2.46,;15.13,-3.79,;16.67,-3.79,;17.44,-5.13,;16.67,-6.46,;18.98,-5.13,;19.75,-6.46,;21.29,-6.46,;22.06,-5.13,;21.29,-3.79,;19.75,-3.79,;23.6,-5.13,;23.6,-3.59,;23.6,-6.67,;25.14,-5.13,;25.91,-3.79,;27.45,-3.79,;28.22,-5.13,;27.45,-6.46,;25.91,-6.46,;14.36,-5.13,;12.82,-5.13,)|

BDBM188307

C=CCn1c(NS(=O)(=O)c2ccccc2)c(C#N)c2nc3ccccc3nc12

BDBM188305

CC(=O)C(C(C)=O)C1=CC(=O)C(=O)c2ccccc12 |t:7|

BDBM119890

CC(C)(C)NC(=O)C(=O)NCc1cccnc1

BDBM188278

CC(C)Oc1ccc(CNC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1

BDBM188227

CC(C)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1

BDBM119879

CC(C)c1ccc(NC(=O)CN(C)S(=O)(=O)c2cc(Br)cnc2N)cc1

BDBM188277

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NC1CC1

BDBM188265

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCCCc1ccccc1

BDBM188273

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccc(Br)cc1

BDBM188222

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccc(C)cc1

BDBM188274

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccc(Cl)cc1

BDBM188275

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccc(F)cc1

BDBM188258

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1cccc(C)c1

BDBM188254

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1ccccc1

BDBM188267

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCc1cccs1

BDBM188232

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cc(C)cc(C)c1

BDBM188247

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cc(C)ccc1C

BDBM188249

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Br)c(C)c1

BDBM188256

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Br)cc1F

BDBM188228

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(C)c(C)c1

BDBM188251

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(C)c(Cl)c1

BDBM188250

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(C)c(F)c1

BDBM188244

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(C)c(c1)N(C)C

BDBM188240

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(Cl)cc1

BDBM188245

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(F)c(Cl)c1

BDBM188231

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(cc1)S(N)(=O)=O

BDBM188241

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2OCCOc2c1

BDBM188248

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2OCOc2c1

BDBM188237

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc(Br)c1

BDBM188226

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc(C)c1

BDBM188236

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc(Cl)c1

BDBM188235

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc(F)c1

BDBM188253

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc(c1)-c1ccno1

BDBM188225

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1

BDBM188242

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccccc1F

BDBM188260

CC(C)n1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1nc2ccc(C)cc2s1

BDBM188303

CC1(C)C2C(=NC1=O)c1ccccc1C(=O)C2=O |c:4|

BDBM69101

CC1CCCCC1NC(=O)CN(C)S(=O)(=O)c1cccc2cccnc12

BDBM188312

CCC(C)n1c(NC(=O)c2ccc(Br)o2)c(C#N)c2nc3ccccc3nc12

BDBM34697

CCC(C)n1c(NC(=O)c2ccccc2)c(C#N)c2nc3ccccc3nc12

BDBM188310

CCCCCn1c(NC(=O)c2ccc(Br)o2)c(C#N)c2nc3ccccc3nc12

BDBM119885

CCCCN(C)C(=O)CCNS(=O)(=O)c1cc(Br)cnc1N

BDBM119887

CCCCNS(=O)(=O)c1cc(Br)cnc1N

BDBM188306

CCCCn1c(NC(=O)c2ccc(Br)o2)c(C#N)c2nc3ccccc3nc12

BDBM32062

CCCCn1c(NC(=O)c2ccccc2)c(C#N)c2nc3ccccc3nc12

BDBM188309

CCCCn1c(NC(=O)c2cccs2)c(C#N)c2nc3ccccc3nc12

BDBM188308

CCCCn1c(NS(=O)(=O)c2ccc(C)cc2)c(C#N)c2nc3ccccc3nc12

BDBM188316

CCCN(C(=O)c1ccc(COC)o1)c1nc-2c(CCc3c-2cnn3C)s1

BDBM34905

CCCc1nn(C)c2nc(=O)n(C)c(=O)c2n1

BDBM188322

CCN(C(=O)C1CCCO1)c1nc-2c(CCc3c-2cnn3C)s1

BDBM119882

CCN(Cc1ccccc1)C(=O)CN(C)S(=O)(=O)c1cc(Br)cnc1N

BDBM188323

CCOC(=O)\C=C/CBr

BDBM76505

CCOC(=O)c1c(NS(=O)(=O)c2ccccc2)n(CCCOC)c2nc3ccccc3nc12

BDBM188243

CCOC(=O)c1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1

BDBM188279

CCOc1ccc(CNC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1OC

BDBM188261

CCOc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(CC)cn2)cc1

BDBM188238

CCOc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1

BDBM188297

CCOc1ccc2cc(CNc3ccc(O)cc3)c(O)nc2c1

BDBM188280

CCOc1ccc2nc(NC(=O)C3CCN(CC3)S(=O)(=O)c3cn(CC)cn3)sc2c1

BDBM188268

CCOc1ccc2nc(NC(=O)C3CCN(CC3)S(=O)(=O)c3cn(cn3)C(C)C)sc2c1

BDBM188302

CCOc1ccc2nc(O)c(CNc3ccc4[nH]ncc4c3)cc2c1

BDBM188272

CCOc1ccccc1CNC(=O)C1CCN(CC1)S(=O)(=O)c1cn(cn1)C(C)C

BDBM188283

CCSc1nnc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(CC)cn2)s1

BDBM188257

CCc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(CC)cn2)cc1

BDBM188230

CCc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1

BDBM188301

CCc1ccc2nc(O)c(CNc3ccc(cc3)N(C)C)cc2c1

BDBM188229

CCc1cccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)c1

BDBM188284

CCn1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)NCCc1nc2cc(C)ccc2[nH]1

BDBM188262

CCn1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(C)c(Cl)c1

BDBM188266

CCn1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(OC)c(Cl)c1

BDBM188259

CCn1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc(OC)cc1

BDBM188263

CCn1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1ccc2OCCOc2c1

BDBM188271

CCn1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1cccc(c1)-c1ccno1

BDBM188281

CCn1cnc(c1)S(=O)(=O)N1CCC(CC1)C(=O)Nc1nc2ccc(OC)cc2s1

BDBM43224

CCn1nc(\C=C\c2ccccc2)nc2c1nc(=O)n(C)c2=O

BDBM50420474

CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(OC)cc1

BDBM188293

CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(cc1)C(=O)OC

BDBM188292

CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(cc1)[N+]([O-])=O

BDBM31040

CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccccc1

BDBM188288

CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccccc1C

BDBM188290

CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccccc1Cl

BDBM188287

CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1cccnc1

BDBM31044

CCn1nc(nc2c1nc(=O)n(C)c2=O)-c1cccs1

BDBM188317

CN(C(=O)Cc1cccs1)c1nc-2c(CCc3c-2cnn3C)s1

BDBM188319

CN(C(=O)c1ccc(Cn2cccn2)o1)c1nc-2c(CCc3c-2cnn3C)s1

BDBM188320

CN(C(=O)c1ccc2OCCOc2c1)c1nc-2c(CCc3c-2cnn3C)s1

BDBM50241461

CN(C)c1ccc2nc3ccc(cc3sc2c1)=[N+](C)C |(17.73,-40.24,;19.06,-41.01,;19.06,-42.55,;20.39,-40.24,;20.4,-38.7,;21.73,-37.93,;23.06,-38.69,;24.39,-37.91,;25.73,-38.69,;27.06,-37.93,;28.39,-38.69,;28.39,-40.23,;27.06,-41,;25.73,-40.23,;24.39,-41.01,;23.06,-40.24,;21.73,-41.01,;29.73,-41,;29.73,-42.54,;31.06,-40.23,)|

BDBM188224

CN(CC(=O)NCc1ccc(C)cc1)S(=O)(=O)c1cc(Br)cnc1N

BDBM119881

CN(CC(=O)Nc1ccc(Br)c(C)c1)S(=O)(=O)c1cc(Br)cnc1N

BDBM119880

CN(CC(=O)Nc1ccc(F)c(Cl)c1)S(=O)(=O)c1cc(Br)cnc1N

BDBM188223

CN(CC(=O)Nc1ccc(F)cc1)S(=O)(=O)c1cc(Br)cnc1N

BDBM119883

CN(Cc1ccccc1)C(=O)CN(C)S(=O)(=O)c1cc(Br)cnc1N

BDBM119888

CN1CCN(CC1)S(=O)(=O)c1cc(Br)cnc1N

BDBM188295

CN1N=C(Nc2c1nc(O)n(C)c2=O)c1ccccc1 |c:2|

BDBM188321

COC1CCCC(C1)C(=O)N(CC1CCCO1)c1nc-2c(CCc3c-2cnn3C)s1

BDBM30768

COCCCn1c(N)c(C(=O)NCCC(C)C)c2nc3ccccc3nc12

BDBM188315

COCCN(C(=O)c1cccs1)c1nc-2c(CCc3c-2cnn3C)s1

BDBM188318

COCCN(C(=O)c1nsc(Cl)c1Cl)c1nc-2c(CCc3c-2cnn3C)s1

BDBM188311

COCCn1c(NC(=O)c2cccc(c2)[N+]([O-])=O)c(C#N)c2nc3ccccc3nc12

BDBM188270

COc1cc(Cl)c(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)c(OC)c1

BDBM188264

COc1cc(OC)c(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1Cl

BDBM92887

COc1ccc(C(=O)N2CCC3(CC2)N(CN(CC(=O)NCCc2ccc(Cl)cc2Cl)C3=O)c2ccccc2)c(OC)c1

BDBM92888

COc1ccc(C(=O)N2CCC3(CC2)N(CN(CC(=O)NCCc2ccc(cc2)C(F)(F)F)C3=O)c2ccccc2)c(OC)c1

BDBM188282

COc1ccc(CCNC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1OC

BDBM188276

COc1ccc(CNC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1

BDBM188255

COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)c(OC)c1

BDBM188239

COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1

BDBM188252

COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1Cl

BDBM188246

COc1ccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)cc1OC

BDBM119878

COc1ccc(NC(=O)CN(C)S(=O)(=O)c2cc(Br)cnc2N)cc1

BDBM119876

COc1ccc(NC(=O)CN(C)S(=O)(=O)c2cc(Br)cnc2N)cc1Cl

BDBM119877

COc1ccc(NC(=O)CN(C)S(=O)(=O)c2cc(Br)cnc2N)cc1OC

BDBM188286

COc1ccc(cc1)-c1nn(C)c2nc(=O)n(C)c(=O)c2n1

BDBM50438918

COc1ccc(cc1OC)-c1nn(C)c2nc(=O)n(C)c(=O)c2n1

BDBM188296

COc1ccc2cc(CNc3ccc(O)cc3)c(O)nc2c1

BDBM188269

COc1ccc2nc(NC(=O)C3CCN(CC3)S(=O)(=O)c3cn(cn3)C(C)C)sc2c1

BDBM188234

COc1cccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)c1

BDBM92889

COc1cccc(c1)C(=O)N1CCC2(CC1)N(CN(CC(=O)NCCc1ccc(cc1)C(F)(F)F)C2=O)c1ccccc1

BDBM188233

CSc1cccc(NC(=O)C2CCN(CC2)S(=O)(=O)c2cn(cn2)C(C)C)c1

BDBM50438910

Cc1ccc(cc1)-c1nn(C)c2nc(=O)n(C)c(=O)c2n1

BDBM188300

Cc1ccc2cc(CNc3ccc(O)cc3)c(O)nc2c1

BDBM34671

Cc1nn(C)c2nc(=O)n(C)c(=O)c2n1

BDBM188294

Cn1c(=O)nc2[nH]nc(\C=C\c3ccccc3)nc2c1=O

BDBM188314

Cn1c(N)c(C(=O)NCc2ccccc2)c2nc3ccccc3nc12

BDBM188285

Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(Cl)c(Cl)c1

BDBM40314

Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(Cl)cc1

BDBM188291

Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(F)cc1

BDBM50438912

Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(cc1)C(F)(F)F

BDBM188289

Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc(cc1)[N+]([O-])=O

BDBM50392849

Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccc2OCOc2c1

BDBM36527

Cn1nc(nc2c1nc(=O)n(C)c2=O)-c1ccccc1

BDBM119889

NC(=O)C(=O)NCc1cccnc1

BDBM50099737

Nc1ccc-2c(c1)C(=O)C(=O)c1ccccc-21

BDBM119886

Nc1ncc(Br)cc1S(=O)(=O)NCCC(=O)Nc1cccc(Cl)c1

BDBM54927

O=C1C=C(NCc2ccccc2)c2ccccc2C1=O |t:2|

BDBM188304

O=C1c2nn(nc2-c2ccccc2C1=O)-c1ccccc1

BDBM188299

Oc1ccc(NCc2cc3cc4OCOc4cc3nc2O)cc1

BDBM188298

Oc1ccc(NCc2cc3ccccc3nc2O)cc1

BDBM188313

[O-][N+](=O)c1cc(ccc1Cl)C(=O)Nc1c(C#N)c2nc3ccccc3nc2n1Cc1ccccc1

BDBM22858

[O-][N+](=O)c1ccc-2c(c1)C(=O)C(=O)c1ccccc-21