Molecule Details

Cc1cc(NC(=O)Cc2cncnc2)cc(OC2CC(=O)N2)c1
3-aminopyridine-like Assayed
View on Fragalysis x10322
Molecular Properties
SMILES:
Cc1cc(NC(=O)Cc2cncnc2)cc(OC2CC(=O)N2)c1
MW: 312.12
Fraction sp3: 0.25
HBA: 5
HBD: 2
Rotatable Bonds: 5
TPSA: 93.21
cLogP: 1.19
Covalent Warhead:
Covalent Fragment: ✔️
Activity Data
IC50 (µM) - Fluorescence: 34.3199073353597
pIC50 (µM) - Fluorescence 4.46445389342812
Average Inhibition @ 20 µM - Fluorescence: 49.30711
Average Inhibition @ 50 µM - Fluorescence: 72.72272
Average Inhibition @ 50 µM - RapidFire: 44.951235785
Relative Solubility @ 20 µM: 1.01
Relative Solubility @ 100 µM: 1.0
Order Status
Ordered: 2020-05-17
Synthesis Location: enamine
Shipped: 2020-06-10

betalactam

b-lactam

O=C(Cc1cncnc1)Nc1cc(F)cc(OC2CC(=O)N2)c1

RAL-MED-2de63afb-14
0.704

View
N#Cc1cc(NC(=O)Cc2cncnc2)cc(OC2CC(=O)N2)c1

TRY-UNI-bbd40bb4-1
0.685

View
O=C(Cc1cncnc1)Nc1cccc(OC2CC(=O)N2)c1

BAR-COM-4e090d3a-39
0.644

View
Cc1cc(CC(=O)Nc2cnccc2C)cc(OC2CC(=O)N2)c1

RAL-THA-901e9a10-1
0.488

View
O=C(Cc1cccnc1)Nc1cccc(OC2CC(=O)N2)c1

RAL-MED-2de63afb-1
0.481

View
Cc1ccncc1CC(=O)Nc1cc(C#N)cc(OC2CC(=O)N2)c1

TRY-UNI-bbd40bb4-2
0.472

View
O=C(Cc1cncnc1)Nc1cccc(CC2CC(=O)N2)c1

RAL-MED-2de63afb-7
0.439

View
O=C(Cc1ccccc1)Nc1cccc(OC2CC(=O)N2)c1

RAL-MED-2de63afb-6
0.427

View
O=C(Cc1cncnc1)Nc1cccc(CC2CCC(=O)N2)c1

RAL-MED-2de63afb-8
0.424

View
CCc1cc(CC(=O)Nc2cnccc2C)cc(OC2CC(=O)N2)c1

RAL-THA-901e9a10-6
0.418

View
O=C1CC(c2cccc(NC(=O)Cc3cncnc3)c2)CN1

RAL-MED-2de63afb-3
0.412

View
CCC(=O)Nc1cccc(OC2CC(=O)N2)c1

RAL-MED-2de63afb-11
0.410

View
O=C(Cc1cncc2ccccc12)Nc1cc(Cl)cc(OC2CC(=O)N2)c1

ERI-UCB-ce40166b-5
0.408

View
N#Cc1cc(NC(=O)Cc2cncc3ccccc23)cc(OC2CC(=O)N2)c1

ERI-UCB-ce40166b-9
0.404

View
COc1cc(CC(=O)Nc2cnccc2C)cc(OC2CC(=O)N2)c1

RAL-THA-901e9a10-5
0.402

View
Cc1ccncc1NC(=O)Cc1cc(F)cc(OC2CC(=O)N2)c1

RAL-THA-901e9a10-2
0.398

View
Cc1ccncc1NC(=O)Cc1cc(Cl)cc(OC2CC(=O)N2)c1

TRY-UNI-2eddb1ff-7
0.398

View
Cc1ccncc1NC(=O)Cc1cc(Cl)cc(OC2CC(=O)N2)c1

WIL-MOD-03b86a88-1
0.398

View
O=C(Cc1cncnc1)Nc1cccc([C@H]2NCCNC2=O)c1

ADA-UCB-b1b30a00-3
0.398

View
O=C(Cc1cncnc1)Nc1cccnc1

SAD-SAT-24589cd1-4
0.392

View
C[C@H](C(=O)Nc1cccc(OC2CC(=O)N2)c1)c1cncnc1

RAL-MED-2de63afb-16
0.391

View
O=C(Cc1cncnc1)Nc1cccc(CC2CNC(=O)N2)c1

RAL-MED-2de63afb-13
0.391

View
C[C@@H](C(=O)Nc1cccc(OC2CC(=O)N2)c1)c1cncnc1

RAL-MED-2de63afb-15
0.391

View
O=C1CC(Oc2cccc(C(=O)NCc3cncnc3)c2)N1

RAL-MED-2de63afb-5
0.386

View
Cc1ccncc1NC(=O)Cc1cc(C#N)cc(OC2CC(=O)N2)c1

RAL-THA-901e9a10-3
0.385

View
Cc1ccncc1NC(=O)Cc1cc(C#N)cc(OC2CC(=O)N2)c1

TRY-UNI-2eddb1ff-6
0.385

View
C#Cc1cc(CC(=O)Nc2cnccc2C)cc(OC2CC(=O)N2)c1

RAL-THA-901e9a10-4
0.385

View
Cc1ccncc1NC(=O)Cc1cccc(OC2CC(=O)N2)c1

RAL-THA-901e9a10-7
0.385

View
Cc1ccncc1NC(=O)Cc1cccc(OC2CC(=O)N2)c1

BRU-LEF-c49414a7-1
0.385

View
O=C1CC(Oc2cccc(NC(=O)C(=O)c3cncnc3)c2)N1

RAL-MED-2de63afb-4
0.379

View
CN(C)C(NC(=O)Cc1cncnc1)C1CCC1

MAK-UNK-748f8b7a-3
0.372

View
O=C(Cc1cncc2ccccc12)Nc1cccc(OC2CC(=O)N2)c1

ERI-UCB-ce40166b-1
0.371

View
O=C(Cc1cncnc1)Nc1cccc(N2CCC2)c1

SAD-SAT-24589cd1-2
0.357

View
CC(=O)NCc1cccc(NC(=O)Cc2cncnc2)c1

RAL-MED-2de63afb-12
0.357

View
C=CC(=O)N(C(=O)Cc1cccc(OC2CC(=O)N2)c1)c1cncnc1

TRY-UNI-69298daf-3
0.351

View
C=CC(=O)N(C(=O)Cc1cc(C#N)cc(OC2CC(=O)N2)c1)c1cncnc1

TRY-UNI-69298daf-4
0.351

View
C/C=C/C(=O)Nc1cccc(OC2CC(=O)N2)c1

RAL-MED-2de63afb-10
0.345

View
O=C(Cc1cc(Cl)cc(OC2CC(=O)N2)c1)Nc1cncc2ccccc12

MAT-POS-3b92565d-3
0.343

View
O=C(Cc1cc(Cl)cc(OC2CC(=O)N2)c1)Nc1cncc2ccccc12

ALP-POS-3b848b35-2
0.343

View
O=C(Cc1cc(Cl)cc(OC2CC(=O)N2)c1)Nc1cncc2ccccc12

EDJ-MED-7320d5d2-1
0.343

View
NC(NC(=O)Cc1cncnc1)C1CC1

MAK-UNK-748f8b7a-16
0.342

View
O=C(Cc1cncnc1)NC1CCNCC1

MAK-UNK-748f8b7a-15
0.342

View
C=CC(=O)Nc1cccc(OC2CC(=O)N2)c1

RAL-MED-2de63afb-9
0.341

View
O=C(Cc1cncnc1)Nc1cccc(CCCc2ccccc2)c1

BAR-COM-4e090d3a-11
0.341

View
CON=C1CC(Oc2cccc(NC(=O)Cc3cccnc3)c2)C1

ANT-OPE-6e66bf84-2
0.340

View
O=C(Cc1cncnc1)NC(=O)C1CC1

MAK-UNK-748f8b7a-14
0.338

View
O=C(Cc1cccnc1)Nc1cccc(OC2CC(=NO)C2)c1

ANT-OPE-6e66bf84-1
0.333

View
CC(C(=O)Nc1cccc(OC2CC(=O)N2)c1)c1cnccn1

BAR-COM-4e090d3a-53
0.333

View
O=C(Cc1cncc2ccccc12)Nc1cc(Cl)cc(OC2CCC(=O)N2)c1

ERI-UCB-ce40166b-6
0.330

View
N#Cc1cc(NC(=O)Cc2cncc3ccccc23)cc(OC2CCC(=O)N2)c1

ERI-UCB-ce40166b-10
0.327

View
Cc1ccncc1NC(=O)Cc1ccc(Cl)c(OC2CC(=O)N2)c1

RAL-THA-901e9a10-8
0.327

View
Cc1ccncc1NC(=O)C(C)c1cc(Cl)cc(OC2CC(=O)N2)c1

TRY-UNI-2eddb1ff-8
0.327

View
CC(NC(=O)Cc1cncnc1)NC1COCC1O

MAK-UNK-748f8b7a-10
0.325

View
O=C(Cc1cncnc1)NC1CCCNC1

MAK-UNK-748f8b7a-7
0.325

View
CCN(C(=O)Nc1cnccc1C)c1cc(Cl)cc(OC2CC(=O)N2)c1

MAR-UCB-ad2ff052-2
0.324

View
O=C(Cc1cc(Cl)cc(OC2CC(=O)N2)c1)Nc1nc2ccccc2[nH]1

ALP-POS-a30bcdb4-1
0.324

View
Cn1cc(NC(=O)Cc2cc(Cl)cc(OC3CC(=O)N3)c2)c2ccccc2c1=O

MAT-POS-3b92565d-9
0.320

View
Cc1ccncc1NC(=O)N(C)c1cc(Cl)cc(OC2CC(=O)N2)c1

MAR-UCB-ad2ff052-1
0.320

View
O=C(Cc1cncc2ccccc12)Nc1cccc(OC2CCC(=O)N2)c1

ERI-UCB-ce40166b-2
0.317

View
C=CC(=O)N(C(=O)Cc1cccc(OC2CC(=O)N2)c1)c1cnccc1C

TRY-UNI-69298daf-1
0.314

View
CC(CO)(NC1CC1)C(=O)Cc1cncnc1

MAK-UNK-748f8b7a-2
0.309

View
C=CC(=O)N(C(=O)Cc1cc(C#N)cc(OC2CC(=O)N2)c1)c1cnccc1C

TRY-UNI-69298daf-2
0.308

View
CC(O)C(NC(=O)Cc1cncnc1)N(C)C

MAK-UNK-748f8b7a-12
0.308

View
O=C(Cc1cc(Cl)cc(OC2CC(=O)N2)c1)Nc1cc(=O)[nH]c2ccccc12

MAT-POS-3b92565d-6
0.308

View
CCCCC(C(=O)Nc1cnccc1C)c1cc(Cl)cc(OC2CC(=O)N2)c1

JAN-GHE-f4ca5a00-15
0.306

View
O=C(Cc1cncnc1)NCCOC1CNC1

MAK-UNK-748f8b7a-4
0.305

View
Cc1ccncc1NC(=O)C(CCc1ccccc1)c1cc(Cl)cc(OC2CC(=O)N2)c1

ALP-POS-3fc1724e-6
0.304

View
C=CC(=O)N(C(=O)Cc1cccc(OC2CC(=O)N2)c1)c1cccnc1

TRY-UNI-69298daf-5
0.303

View
Cc1cc(C)cc(NC(=O)Cc2cnn(C)c2C)c1

JAG-UCB-a3ef7265-13
0.296

View
C=CC(=O)N(C(=O)Cc1cc(C#N)cc(OC2CC(=O)N2)c1)c1cccnc1

TRY-UNI-69298daf-6
0.295

View
Cc1ccncc1NC(=O)N(CCC1CCCCC1)c1cc(Cl)cc(OC2CC(=O)N2)c1

MAR-UCB-ad2ff052-3
0.295

View
Cc1ccncc1NC(=O)N(CCC1CCCCC1)c1cc(Cl)cc(OC2CC(=O)N2)c1

DAR-DIA-1d7f034a-1
0.295

View
O=C1CC(Oc2cc(Cl)cc(CC(=O)Nn3cnc4ccccc43)c2)N1

MAT-POS-3b92565d-12
0.292

View
O=C1CC(Oc2cc(Cl)cc(CC(=O)Nn3cnc4ccccc43)c2)N1

MAT-POS-c478e61b-1
0.292

View
O=C1CC(Oc2ccc(NC(=O)Nc3cccnc3)s2)N1

TRY-UNI-bbd40bb4-4
0.290

View
O=C1CC(Oc2cc(Cl)cc(CC(=O)Nn3cnc4ccccc4c3=O)c2)N1

JAN-GHE-74b8b0cb-1
0.290

View
Cc1ccncc1NC(=O)C(CCC1CCCCC1)c1cc(Cl)cc(OC2CC(=O)N2)c1

ALP-POS-3fc1724e-5
0.289

View
Cc1ccncc1NC(=O)Nc1ccc(OC2CC(=O)N2)s1

TRY-UNI-bbd40bb4-6
0.289

View
CC1(OCC(=O)Cc2cncnc2)CNC1

MAK-UNK-748f8b7a-8
0.284

View
O=C(Cc1cncnc1)NCN1CCNCC1

MAK-UNK-748f8b7a-5
0.277

View
O=C(Cc1cccc(Cl)c1)Nc1cncnc1

JAN-GHE-5a013bed-9
0.277

View
Cc1cncc(NC(=O)Cc2cccc(Cl)c2)c1

EDG-MED-0da5ad92-12
0.276

View
CC1COC(CO)CN1CNC(=O)Cc1cncnc1

MAK-UNK-748f8b7a-13
0.272

View
Cc1cc(C)cc(NC(=O)Cn2cncc2C)c1

JAG-UCB-a3ef7265-12
0.265

View
Cc1ccncc1CN1C(=O)C(=O)c2ccc(-c3cc(Cl)cc(OC4CC(=O)N4)c3)cc21

DAR-DIA-53551c05-7
0.263

View
O=C(Cc1cncnc1)CN1CCOCC1

MAK-UNK-748f8b7a-11
0.263

View
O=C1CC(c2ccc(NC(=O)c3cncnc3)cc2)NC(=O)N1

MAR-TRE-66ac689e-2
0.261

View
O=C(Cc1cncnc1)CN1CCNCC1

MAK-UNK-748f8b7a-1
0.259

View
O=C(CNC(=O)c1cncnc1)Nc1ccccc1

MAR-TRE-4f781e27-49
0.259

View
O=C(NC1CC(=O)N(CCN2CCOCC2)C1)c1cncnc1

MAR-TRE-c317dd82-69
0.258

View
Cn1cc(CC(=O)Nc2cccnc2)cn1

DAR-DIA-842b4336-11
0.256

View
Cc1ccncc1NC(=O)Cc1cc(Cl)cc(OC2COC2)c1

WIL-MOD-03b86a88-4
0.255

View
Cc1cncc(NC(=O)CNC(=O)CN)c1

MAR-TRE-67513f76-6
0.253

View
O=C1CC(Oc2cc(Cl)cc(C(CCc3ccccc3)C(=O)Nc3nc4ccccc4[nH]3)c2)N1

ALP-POS-a30bcdb4-2
0.252

View
Cc1cc(COC2CCC(NC(=O)c3cncnc3)CC2)on1

MAR-TRE-e82e6c98-78
0.250

View
O=C1CC(Oc2cc(Cl)cc(OCCNC(=O)c3cc(=O)[nH]c4ccccc34)c2)N1

ALP-POS-3fc1724e-2
0.250

View
O=C1CC(Oc2cc(Cl)cc(OCCNC(=O)c3cc(=O)[nH]c4ccccc34)c2)N1

ERI-UCB-ce40166b-17
0.250

View
O=C(Cc1ccc(F)cc1)Nc1cccnc1

MAK-UNK-a7b37c5e-5
0.250

View
CCCC(C(=O)Nn1cnc2ccccc2c1=O)c1cc(Cl)cc(OC2CC(=O)N2)c1

JAN-GHE-74b8b0cb-2
0.250

View
O=C1CC(Cc2ccc(NC(=O)c3cncnc3)cc2)C(=O)N1

MAR-TRE-9d18ae8c-29
0.247

View
CC1=CC(C)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.569

View
CC1=CC(F)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.559

View
CC1=CC(Br)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.551

View
CC1=CC(I)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.551

View
COC1=CC(NC(=O)CC2=CN=CN=C2)=CC(OC)=C1

0.500

View
CC1=CC(NC(=O)CC2=CN=CN=C2)=CC(CN(C)C)=C1

0.493

View
CC1=CC(NC(=O)CC2=CN=CN=C2)=CC(C(F)(F)F)=C1

0.493

View
COC1=CC(Br)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.493

View
CC1=CC(C)=CC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.481

View
O=C(CC1=CN=CN=C1)NC1=CC=CC(OC2CCCC2)=C1

0.481

View
CC1=CC(NC(=O)CC2=CN=CN=C2)=CC(C)=C1Br

0.479

View
CC1=CC(CNC(=O)OC(C)(C)C)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.476

View
CC(C)OC1=CC(Br)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.468

View
COC1=CC(NC(=O)CC2=CN=CN=C2)=CC(OC)=C1C

0.466

View
CCC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1

0.463

View
CC1=CC(C)=CC(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.463

View
COC1=CC(F)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.461

View
COC1=CC(NC(=O)CC2=CN=CN=C2)=CC(O)=C1

0.461

View
CC1=CC=C(NC(=O)CC2=CN=CN=C2)C=C1

0.457

View
CC(C)OC1=CC(F)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.456

View
CC(=O)C1=C(C)C=C(NC(=O)CC2=CN=CN=C2)C=C1C

0.452

View
CC1=CC(C)=CC(OC2=CC=C(NC(=O)CC3=CN=CN=C3)C=C2)=C1

0.450

View
CC1=CN=CC(CCC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.449

View
CC1=CN=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)S1

0.447

View
CC1=CC=CC(NC(=O)CC2=CN=CN=C2)=C1

0.446

View
COC1=CC(NC(=O)CC2=CN=CN=C2)=CC(OC)=C1OC

0.446

View
CC1=CC(CNC(=O)C(F)(F)F)=CC(NC(=O)CC2=CN=CN=C2)=C1

0.446

View
CC(C)OC1=CC=CC(NC(=O)CC2=CN=CN=C2)=C1

0.443

View
COC1=CC=CC(NC(=O)CC2=CN=CN=C2)=C1

0.442

View
COC1=C(Cl)C=C(NC(=O)CC2=CN=CN=C2)C=C1Cl

0.440

View
COC1=C(F)C=C(NC(=O)CC2=CN=CN=C2)C=C1F

0.440

View
CC1=NC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)S1

0.437

View
CC1=CC(C)=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C(C)=C1

0.435

View
CC1=CC(C)=CC(NC(=O)CNC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.435

View
CCCC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1

0.435

View
CC1=CC=C(COC2=CC=CC(NC(=O)CC3=CN=CN=C3)=C2)C=C1

0.435

View
CC1=CC(C)=CC(NC(=O)CNC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.434

View
CCC1=CC=C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)C=C1

0.432

View
CC1=CC(C)=C(NC(=O)CC2=CN=CN=C2)C(C)=C1

0.431

View
CC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1C

0.430

View
CC1=CC(C)=CC(CCC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.430

View
CC(C)CC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1

0.425

View
COC1=CC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=CC(OC)=C1

0.424

View
CC1=CC(C)=CC(OCC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.424

View
CCOC1=C(Cl)C=C(NC(=O)CC2=CN=CN=C2)C=C1Cl

0.423

View
CCC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)N=C1

0.422

View
CC1=CC=C(C)C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.420

View
CC1=CC(C)=CC(OCCC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.420

View
CCCCC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1

0.420

View
CC1=NOC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.420

View
CC(C)(C)C1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1

0.419

View
CC1=CC=C(OC2=CC=C(NC(=O)CC3=CN=CN=C3)C=C2)C=C1

0.418

View
CC(C)OC1=C(F)C=C(NC(=O)CC2=CN=CN=C2)C=C1F

0.418

View
CC1=CC(C)=C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)C(C)=C1

0.417

View
CC1=CC=CC(OC2=CC=C(NC(=O)CC3=CN=CN=C3)C=C2)=C1

0.417

View
CC(C)OC1=CC(NC(=O)CC2=CN=CN=C2)=CC(C(F)(F)F)=C1

0.417

View
CC1=NC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C(C)S1

0.416

View
CC(C)OC1=CC=CC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.416

View
CC1=CC(NC(=O)CC2=CN=CN=C2)=C[NH]C1=O

0.416

View
COC1=CC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=CC(OC)=C1OC

0.414

View
CC1=CC(C)=CC(NC(=O)COC(=O)CC2=CN=CN=C2)=C1

0.412

View
CC1=CC=CC(C)=C1CC(=O)NC1=CC=CC(OC2CC(=O)N2)=C1

0.412

View
CC1=CC=C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)C=C1C

0.412

View
CC1=CN=CC(CCC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.411

View
COC1=CC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=CC=C1C

0.411

View
CCOC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1

0.409

View
CN1C=CC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=N1

0.409

View
CC1=CC=C(C)C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.407

View
CC1=CC(C)=CC(OCC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.405

View
COC1=CC(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=CC(OC)=C1

0.405

View
CCCC1=CC=C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)C=C1

0.405

View
CCSC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1

0.404

View
CC1=NOC(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.402

View
CC1=NN(C)C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.400

View
COC1=CC=C(C)C=C1CC(=O)NC1=CC=CC(OC2CC(=O)N2)=C1

0.400

View
CC1=NC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=CS1

0.400

View
COCC1=CC=CC(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.400

View
COC1=CC=C(CC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C=C1OC

0.400

View
COC1=CC(NC(=O)CNC(=O)CC2=CN=CN=C2)=CC(OC)=C1

0.400

View
CC1=CC=CC(NC(=O)CSCC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)=C1

0.398

View
CC1=NN(C)C(C)=C1CC(=O)NC1=CC=CC(OC2CC(=O)N2)=C1

0.396

View
COC1=CC=CC(OC)=C1CC(=O)NC1=CC=CC(OC2CC(=O)N2)=C1

0.395

View
COC1=CC(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=CC=C1C

0.393

View
CN1N=CC=C1CC(=O)NC1=CC=CC(OC2CC(=O)N2)=C1

0.393

View
CN1N=CC(Cl)=C1CC(=O)NC1=CC=CC(OC2CC(=O)N2)=C1

0.391

View
COC1=CC(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=CC(OC)=C1OC

0.391

View
CC1=CC(C)=CC(CCC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.391

View
CC1=CC(C)=C(OCC(=O)NC2=CC=CC(OC3CC(=O)N3)=C2)C(C)=C1

0.389

View
CC1=NN(C)C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.386

View
CC1=NC(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C(C)S1

0.386

View
CCOC1=CC=C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)C=C1

0.384

View
COC1=CC=C(C)C=C1CC(=O)NC1=CC=C(OC2CC(=O)N2)C=C1

0.382

View
CC1=CC(C)=CC(OCCC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)=C1

0.382

View
COC1=CC=C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)C=C1OC

0.382

View
CCSC1=CC=C(CC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)C=C1

0.375

View
CC1=CC=CC(C)=C1CC(=O)NC1=CC=C(OC2CC(=O)N2)C=C1

0.372

View
CC1=CC(C)=C(OCC(=O)NC2=CC=C(OC3CC(=O)N3)C=C2)C(C)=C1

0.371

View
CC1=CN=CC(CC(=O)NC2=CC(C)=CC(C)=C2)=C1

0.368

View
CC1=NN(C)C(C)=C1CC(=O)NC1=CC=C(OC2CC(=O)N2)C=C1

0.367

View
CC1=CC(C)=CC(CC(=O)NC2=CC=CC=C2OC2CC(=O)N2)=C1

0.364

View

C(NC1C=CC=C(OC(C)C)C=1)(=O)CC1=CN=CN=C1

0.443

View
C(NC1C=CC=C(OC)C=1)(=O)CC1=CN=CN=C1

0.442

View
C(NC1=CC=C(OCC)C=C1)(=O)CC1=CN=CN=C1

0.403

View
C(NC1=CC(OC)=C(C)C=C1)(=O)CC1=CN=CN=C1

0.400

View
C(NC1=CC=CC(OCC2=CC=CC=C2)=C1)(=O)CC1=CN=CN=C1

0.391

View
C(NC1=CC=CC(OCC#N)=C1)(=O)CC1=CN=CN=C1

0.388

View
C(NC1C=CC=C(OCC#C)C=1)(=O)CC1=CN=CN=C1

0.388

View
C(NC1=CC=C(OCCCC)C=C1)(=O)CC1=CN=CN=C1

0.383

View
C(NC1=C(C)C=C(OC)C=C1)(=O)CC1=CN=CN=C1

0.375

View
C(NC1=C(C)C=CC(OC)=C1)(=O)CC1=CN=CN=C1

0.366

View
C(NC1C(OC)=CC=C(C)C=1)(=O)CC1=CN=CN=C1

0.366

View
C(NC1=C(C)C(OC)=CC=C1)(=O)CC1=CN=CN=C1

0.349

View


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