Molecular Properties | |
SMILES: | N#CC(=O)N1CCN(S(=O)(=O)c2c(F)cccc2F)CC1 |
MW: | 315.05 |
Fraction sp3: | 0.33 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 81.48 |
cLogP: | 0.32 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Cyano carbonyl compounds
Activated haloaromatics
N-C-Hal or cyano methyl
Hetero_hetero
acyl_cyanide
LON-WEI-8f408cad-3
JAG-SYN-9c2cd0bd-2
0.765
MAK-UNK-6435e6c2-6
0.667
JAG-SYN-9c2cd0bd-1
0.618
LON-WEI-8f408cad-2
0.607
MAR-TRE-6a44bbf2-4
0.607
AAR-POS-d2a4d1df-32
0.607
JAG-SYN-9c2cd0bd-12
0.576
JAG-SYN-9c2cd0bd-13
0.576
MAK-UNK-10dfa458-29
0.559
BEN-DND-76ad4ac9-12
0.540
BEN-DND-03406596-2
0.540
MAK-UNK-10dfa458-26
0.525
JAG-SYN-9c2cd0bd-11
0.517
NAU-LAT-64f4b287-1
0.515
JAG-SYN-9c2cd0bd-15
0.508
MAK-UNK-10dfa458-46
0.483
BEN-DND-76ad4ac9-2
0.475
MAK-UNK-10dfa458-30
0.459
MAK-UNK-902cc841-9
0.447
MAK-UNK-902cc841-10
0.436
SWA-SYN-d2e6fa14-4
0.425
SWA-SYN-6423ea73-4
0.425
JAG-SYN-9c2cd0bd-10
0.394
PEI-IMP-3d837503-4
0.381
DRR-IMP-dff87f5e-4
0.359
JAN-GHE-bf40f168-1
0.351
MAK-UNK-6435e6c2-5
0.338
DRR-IMP-dff87f5e-5
0.333
AAR-POS-d2a4d1df-34
0.333
MAR-TRE-6a44bbf2-8
0.333
MAK-UNK-3f402c2b-9
0.333
SAD-SAT-bc31ec01-10
0.329
JOE-SYG-2c9a1216-3
0.329
MAK-UNK-10dfa458-21
0.328
JOE-SYG-2c9a1216-1
0.325
BEN-DND-76ad4ac9-11
0.324
BEN-DND-03406596-9
0.324
DAN-MCD-50ec7d1f-1
0.319
MAR-TRE-6a44bbf2-18
0.319
BEN-DND-03406596-10
0.319
LON-WEI-8f408cad-4
0.319
DAN-MCD-5c762fbe-1
0.319
MAK-UNK-10dfa458-5
0.319
AAR-POS-d2a4d1df-23
0.319
BEN-DND-03ad4429-3
0.319
MAK-UNK-6ca90168-17
0.316
MAK-UNK-10dfa458-20
0.313
MAR-TRE-6a44bbf2-32
0.310
ABB-MCD-f8003a30-1
0.310
MAK-UNK-6435e6c2-1
0.308
BEN-DND-03406596-3
0.307
BEN-DND-76ad4ac9-14
0.307
AAR-POS-d2a4d1df-37
0.297
KEN-MCD-6084b33e-1
0.297
MAR-TRE-6a44bbf2-7
0.297
JON-UIO-066ce08b-6
0.296
DRR-IMP-dff87f5e-9
0.296
ALE-MCD-a1893bfb-1
0.292
DRR-IMP-dff87f5e-8
0.292
MAK-UNK-7c9d1431-10
0.292
ANT-OPE-7824651a-2
0.292
MAR-TRE-6a44bbf2-52
0.290
AAR-POS-d2a4d1df-22
0.290
LON-WEI-8f408cad-3
0.290
KAY-MCD-d0fe5261-1
0.290
DRR-IMP-dff87f5e-1
0.290
MAR-TRE-6a44bbf2-58
0.290
DRR-IMP-db50bf6e-5
0.290
BEN-DND-03ad4429-7
0.290
MAK-UNK-10dfa458-4
0.290
IND-SYN-6c8299e8-2
0.289
PEI-IMP-ca0b2813-3
0.289
JOE-SYG-2c9a1216-2
0.289
BEN-DND-03ad4429-4
0.287
KAT-UNK-b2a0d5b1-1
0.284
PEI-IMP-3d837503-2
0.284
NIM-UNI-05f93fcc-2
0.282
BEN-DND-03406596-8
0.280
JON-UIO-066ce08b-8
0.280
MAR-TRE-6a44bbf2-65
0.280
TAT-ENA-80bfd3e5-43
0.280
MAK-UNK-7c9d1431-11
0.280
MAT-POS-590ac91e-61
0.280
MAR-TRE-6a44bbf2-21
0.279
MAK-UNK-7c9d1431-9
0.279
BEN-DND-03406596-6
0.278
BEN-DND-76ad4ac9-10
0.278
MAT-POS-590ac91e-70
0.278
MAK-UNK-7c9d1431-6
0.278
SAD-SAT-9a6c5cf3-10
0.277
MAK-UNK-4c6b313a-1
0.277
MAK-UNK-6435e6c2-11
0.277
MAK-UNK-6435e6c2-10
0.277
MAT-POS-590ac91e-62
0.277
BEN-DND-76ad4ac9-13
0.276
BEN-DND-03406596-5
0.276
DRR-IMP-dff87f5e-3
0.275
AAR-POS-d2a4d1df-44
0.275
NIM-UNI-05f93fcc-3
0.275
MAK-UNK-7c9d1431-4
0.273