Molecular Properties | |
SMILES: | O=C1NC2(C(=O)Nc3ccc(Cl)cc32)C(=O)N1c1cncc2ccc(F)cc12 |
MW: | 396.04 |
Fraction sp3: | 0.05 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 1 |
TPSA: | 91.4 |
cLogP: | 2.93 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2021-03-23 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
beta-keto/anhydride
hydantoin
Dye 11
VLA-UNK-70dd90ef-2
VLA-UNK-70dd90ef-2
0.699
MAT-POS-61f37a1a-14
0.543
YVE-CNR-132fc2df-1
0.446
YVE-CNR-7d92d73e-1
0.390
MAT-POS-8293a91a-8
0.390
VLA-UNK-70dd90ef-1
0.388
VLA-UNK-70dd90ef-3
0.388
MIK-ENA-610c7cf9-1
0.379
MAT-POS-b4d6b7fc-5
0.379
LUO-POS-b4dec3be-1
0.379
MIK-ENA-4bb8c98f-1
0.379
LUO-POS-b4dec3be-2
0.379
EDJ-MED-b6c6ee2b-6
0.371
EDG-MED-b1ef7fe3-2
0.371
EDJ-MED-b6c6ee2b-7
0.358
VLA-UCB-29506327-1
0.355
VLA-UNK-cf7facf1-1
0.355
VLA-UCB-34f3ed0c-11
0.355
MAT-POS-a9372f04-1
0.352
EDJ-MED-9e38fd34-2
0.350
EDJ-MED-9e38fd34-1
0.350
EDJ-MED-9e38fd34-3
0.350
VLA-UNK-c65c1026-4
0.349
VLA-UNK-83c3754c-1
0.349
VLA-UNK-70dd90ef-4
0.349
MAT-POS-853c0ffa-21
0.347
VLA-MRT-a639d434-2
0.345
VLA-MRT-8c78ee15-4
0.345
VLA-MRT-8c78ee15-1
0.343
VLA-MRT-a639d434-3
0.343
VLA-MRT-8c78ee15-2
0.343
MAT-POS-853c0ffa-13
0.341
MAT-POS-853c0ffa-14
0.339
VLA-UNK-c65c1026-3
0.336
MAT-POS-ddfe83c6-4
0.336
VLA-MRT-a639d434-1
0.336
VLA-MRT-8c78ee15-3
0.336
JOH-MSK-4bb3d434-3
0.333
VLA-UNK-3a43cd95-1
0.333
PET-UNK-b78139fa-16
0.333
VLA-UNK-3a43cd95-2
0.327
PET-UNK-4b4f2bb7-6
0.319
DAR-DIA-6be260fc-2
0.316
DAR-DIA-6be260fc-3
0.315
MAT-POS-c7771779-1
0.315
MIK-ENA-f156d06e-1
0.315
MAT-POS-c2d406ed-1
0.315
VLA-UNK-c65c1026-6
0.312
MAT-POS-ddfe83c6-6
0.311
MAT-POS-c88128cb-12
0.310
PET-UNK-1b92fa34-6
0.310
VLA-UNK-56836b69-5
0.309
EDJ-MED-4cb9dd84-3
0.309
MAT-POS-a334828f-3
0.308
PET-UNK-9bf1291a-2
0.307
VLA-UNK-83c3754c-2
0.306
LUO-POS-8c3e556a-1
0.305
LUO-POS-8c3e556a-2
0.305
EDG-MED-b1ef7fe3-1
0.305
ALP-POS-e0fe77e5-14
0.304
JOH-MSK-51c67e7d-2
0.304
JOH-MSK-51c67e7d-1
0.304
JUL-TUD-06b2044f-72
0.303
JUL-TUD-06b2044f-111
0.302
PET-UNK-407a74a5-16
0.301
MAT-POS-c7771779-2
0.301
MAT-POS-89e65850-1
0.301
EDJ-MED-4cb9dd84-2
0.301
MIK-ENA-434a856c-1
0.301
MIK-ENA-93ef1e28-1
0.301
PET-UNK-b566c0b0-8
0.300
EDJ-MED-b2a1399d-3
0.299
EDJ-MED-841e0cf0-3
0.299
EDJ-MED-923a35c2-5
0.299
EDJ-MED-670ad2ee-3
0.299
MAR-UCB-6ab2ec87-5
0.299
VLA-UNK-56836b69-2
0.297
PET-UNK-2c6614b6-6
0.297
EDJ-MED-cbbe2dbb-4
0.296
MIK-ENA-f73d8b60-1
0.296
DAR-DIA-6be260fc-4
0.296
PET-UNK-eeb64427-2
0.295
PET-UNK-eeb64427-5
0.295
EDJ-MED-24007d8a-1
0.295
DAR-DIA-6be260fc-1
0.295
JAG-UCB-f37eaa14-2
0.295
PET-UNK-626a1084-2
0.294
PET-UNK-626a1084-4
0.294
PET-UNK-49566573-4
0.294
VLA-UNK-f49ebb87-1
0.294
PET-UNK-407a74a5-9
0.293
VLA-UNK-ba665ac8-1
0.293
VLA-UCB-34f3ed0c-12
0.293
PET-UNK-bcc8fd08-2
0.293
PET-UNK-eeb64427-4
0.293
PET-UNK-eeb64427-1
0.293
LUO-POS-e1dab717-4
0.293
PET-UNK-689df078-3
0.292
JOH-MSK-1f2dff76-4
0.292
MAT-POS-90505e2b-1
0.292