Molecular Properties | |
SMILES: | C=CC(=O)N1CCN(S(=O)(=O)c2cccc(F)c2)CC1 |
MW: | 298.08 |
Fraction sp3: | 0.31 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 0.84 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine REAL: | Z2517205787 |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.5 |
Order Status | |
Shipped: | 2021-07-07 |
Activated haloaromatics
Hetero_hetero
LON-WEI-8f408cad-3
BEN-DND-03ad4429-3
1.000
MAK-UNK-6435e6c2-5
0.692
DAN-MCD-5c762fbe-1
0.673
LON-WEI-8f408cad-4
0.643
BEN-DND-03406596-10
0.643
MAR-TRE-6a44bbf2-18
0.643
DAN-MCD-50ec7d1f-1
0.643
AAR-POS-d2a4d1df-23
0.643
MAK-UNK-10dfa458-29
0.632
BEN-DND-03ad4429-4
0.625
PEI-IMP-3d837503-2
0.611
JAG-SYN-9c2cd0bd-1
0.552
BEN-DND-76ad4ac9-14
0.547
BEN-DND-03406596-3
0.547
MAK-UNK-10dfa458-18
0.534
IND-SYN-6c8299e8-7
0.529
BEN-DND-03ad4429-1
0.518
SAD-SAT-b55127ae-5
0.517
BEN-DND-76ad4ac9-6
0.508
AHN-SAT-02ef6d10-5
0.484
MAK-UNK-902cc841-8
0.481
BEN-DND-03ad4429-7
0.475
MAK-UNK-10dfa458-4
0.475
MAK-UNK-902cc841-7
0.474
SAD-SAT-3a925b8b-10
0.467
BEN-DND-03ad4429-2
0.460
AHN-SAT-02ef6d10-10
0.460
MAK-UNK-10dfa458-6
0.459
IND-SYN-6c8299e8-2
0.456
JAN-GHE-4287bd1a-1
0.446
DRR-IMP-dff87f5e-8
0.446
KEN-MCD-4729dc98-1
0.429
MAC-MCD-4707377b-1
0.429
MAR-TRE-6a44bbf2-65
0.426
KEN-MCD-6084b33e-1
0.426
MAK-UNK-7c9d1431-11
0.426
TAT-ENA-80bfd3e5-43
0.426
ANT-OPE-7824651a-2
0.424
SAD-SAT-2ceae68f-1
0.421
ALE-MCD-a1893bfb-1
0.417
MAK-UNK-7c9d1431-4
0.414
TAT-ENA-80bfd3e5-25
0.414
PEI-IMP-ca0b2813-3
0.414
SAD-SAT-1f400d17-10
0.412
ABB-MCD-f8003a30-1
0.403
MAR-TRE-6a44bbf2-32
0.403
MAK-UNK-7c9d1431-10
0.403
AHN-SAT-02ef6d10-7
0.400
KAY-MCD-59dc2eb3-1
0.396
ABB-MCD-f549d731-1
0.391
DRR-IMP-dff87f5e-1
0.385
MAR-TRE-6a44bbf2-58
0.385
KAY-MCD-d0fe5261-1
0.385
ANT-OPE-7824651a-1
0.384
MAK-UNK-3f402c2b-2
0.384
ZAC-MCD-b48cf8fd-1
0.383
JAY-UNK-11f5bdbd-1
0.379
MAR-TRE-6a44bbf2-21
0.375
MAK-UNK-7c9d1431-9
0.375
AHN-SAT-02ef6d10-3
0.375
MAR-TRE-6a44bbf2-26
0.368
MAK-UNK-7c9d1431-8
0.368
SAD-SAT-2ceae68f-7
0.362
ZAC-MCD-2bc172dc-1
0.362
MAT-POS-590ac91e-69
0.360
ANT-OPE-d972fbad-1
0.359
BEN-DND-76ad4ac9-7
0.357
DRR-IMP-dff87f5e-2
0.356
MAK-UNK-7c9d1431-3
0.356
PEI-IMP-3d837503-4
0.354
MIK-MCD-8542a490-1
0.353
MED-COV-4280ac29-14
0.348
PEI-IMP-ca0b2813-1
0.348
JAN-GHE-bf40f168-1
0.347
MAK-UNK-7c9d1431-19
0.347
MAK-UNK-6ca90168-21
0.344
MAK-UNK-6ca90168-12
0.344
MAK-UNK-6435e6c2-6
0.344
DRR-IMP-dff87f5e-7
0.343
MAK-UNK-10dfa458-10
0.343
SAD-SAT-b55127ae-1
0.343
MAT-POS-590ac91e-57
0.341
PEI-IMP-3d837503-3
0.339
LON-WEI-8f408cad-2
0.338
MAR-TRE-6a44bbf2-4
0.338
AAR-POS-d2a4d1df-32
0.338
SAD-SAT-f0a2747f-9
0.338
MAK-MCD-5988fef6-1
0.338
KAT-UNK-b2a0d5b1-1
0.333
MAK-UNK-6435e6c2-10
0.333
MAK-UNK-4c6b313a-1
0.333
NAU-LAT-64f4b287-1
0.333
MAK-UNK-7c9d1431-5
0.333
MAK-UNK-7c9d1431-7
0.333
SAD-SAT-bc31ec01-9
0.333
MAK-UNK-6ca90168-13
0.333
MAK-UNK-6435e6c2-11
0.333
MAR-TRE-6a44bbf2-31
0.333
MAR-TRE-6a44bbf2-49
0.333
MAR-TRE-6a44bbf2-38
0.329