Molecular Properties | |
SMILES: | N#Cc1c(F)cccc1-c1ccccc1S(=O)(=O)N1CCN(C(=O)CCl)CC1 |
MW: | 421.07 |
Fraction sp3: | 0.26 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 4 |
TPSA: | 81.48 |
cLogP: | 2.44 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Hetero_hetero
MAK-UNK-c74072e5-4
0.733
DRR-IMP-dff87f5e-5
0.563
MAR-TRE-6a44bbf2-8
0.563
AAR-POS-d2a4d1df-34
0.563
AAR-POS-d2a4d1df-37
0.533
MAR-TRE-6a44bbf2-7
0.533
PEI-IMP-668afc53-1
0.524
PEI-IMP-ca0b2813-4
0.512
BEN-DND-03406596-9
0.500
BEN-DND-76ad4ac9-11
0.500
MAK-UNK-7c9d1431-12
0.493
AAR-POS-d2a4d1df-32
0.473
MAR-TRE-6a44bbf2-4
0.473
LON-WEI-8f408cad-2
0.473
BEN-DND-76ad4ac9-12
0.450
BEN-DND-03406596-2
0.450
DRR-IMP-db50bf6e-4
0.450
KAT-UNK-b2a0d5b1-1
0.443
SAD-SAT-9a6c5cf3-10
0.437
BEN-DND-03406596-10
0.429
AAR-POS-d2a4d1df-23
0.429
MAR-TRE-6a44bbf2-18
0.429
LON-WEI-8f408cad-4
0.429
DRR-IMP-dff87f5e-9
0.423
SAD-SAT-f2e2579e-4
0.418
MAK-UNK-7c9d1431-9
0.413
MAR-TRE-6a44bbf2-21
0.413
DRR-IMP-dff87f5e-4
0.413
IND-SYN-6c8299e8-2
0.410
BEN-DND-03406596-3
0.410
BEN-DND-76ad4ac9-14
0.410
MAR-TRE-6a44bbf2-58
0.403
KAY-MCD-d0fe5261-1
0.403
DRR-IMP-dff87f5e-1
0.403
TAT-ENA-80bfd3e5-43
0.402
MAK-UNK-7c9d1431-11
0.402
MAR-TRE-6a44bbf2-65
0.402
ABB-MCD-f8003a30-1
0.400
MAR-TRE-6a44bbf2-32
0.400
MAK-UNK-7c9d1431-10
0.400
DRR-IMP-dff87f5e-8
0.400
BEN-DND-03406596-6
0.395
BEN-DND-76ad4ac9-10
0.395
AAR-POS-0daf6b7e-3
0.395
MAR-TRE-6a44bbf2-13
0.395
WAR-XCH-79d12f6e-6
0.395
AAR-POS-d2a4d1df-36
0.395
RHE-UNK-eb059eb9-1
0.395
NIM-UNI-05f93fcc-3
0.391
AAR-POS-d2a4d1df-44
0.390
DRR-IMP-dff87f5e-3
0.390
MAK-UNK-7c9d1431-8
0.388
MAR-TRE-6a44bbf2-26
0.388
BEN-DND-03406596-8
0.386
LON-WEI-8f408cad-3
0.385
MAR-TRE-6a44bbf2-52
0.385
SAD-SAT-3a925b8b-2
0.385
MAT-POS-ee51dedd-2
0.385
AAR-POS-d2a4d1df-22
0.385
NIM-UNI-05f93fcc-1
0.380
SAD-SAT-3a925b8b-6
0.380
MAK-UNK-7c9d1431-4
0.376
TAT-ENA-80bfd3e5-25
0.376
PEI-IMP-ca0b2813-3
0.376
SAD-SAT-f2e2579e-6
0.376
MAR-TRE-6a44bbf2-45
0.372
MAK-UNK-7c9d1431-30
0.372
MAK-UNK-7c9d1431-6
0.370
PEI-IMP-ca0b2813-1
0.370
DRR-IMP-dff87f5e-6
0.370
NIM-UNI-05f93fcc-2
0.368
PEI-IMP-ca0b2813-2
0.367
MAR-LAB-efb042c5-5
0.367
MAR-TRE-6a44bbf2-68
0.367
AAR-POS-0daf6b7e-15
0.367
AAR-POS-d2a4d1df-27
0.367
DRR-IMP-dff87f5e-7
0.367
BEN-DND-03406596-5
0.365
BEN-DND-76ad4ac9-13
0.365
JAY-UNK-11f5bdbd-1
0.362
MAR-TRE-6a44bbf2-78
0.362
MAK-UNK-7c9d1431-13
0.362
NAU-LAT-f723e322-5
0.362
MAK-UNK-7c9d1431-3
0.360
DRR-IMP-dff87f5e-2
0.360
MAK-UNK-7c9d1431-7
0.356
MAR-TRE-6a44bbf2-49
0.356
SAD-SAT-bc31ec01-5
0.354
MAK-UNK-c74072e5-8
0.354
MAK-UNK-7c9d1431-17
0.354
MAK-UNK-7c9d1431-19
0.353
MAK-UNK-d4768348-1
0.350
MAK-UNK-d4768348-4
0.350
DRR-IMP-db50bf6e-5
0.350
SAD-SAT-3a925b8b-9
0.350
AHN-SAT-de2502ba-15
0.349
SAD-SAT-bc31ec01-4
0.349
SAD-SAT-5b1897b2-10
0.346
MAK-UNK-d4768348-5
0.346
MAK-UNK-d4768348-2
0.346