Molecular Properties | |
SMILES: | O=C(CCl)C1CCN(S(=O)(=O)c2cccs2)CC1 |
MW: | 307.01 |
Fraction sp3: | 0.55 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 4 |
TPSA: | 54.45 |
cLogP: | 1.96 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Ketones
Filter64_halo_ketone_sulfone
aliphatic ketone not ring and not di-carbonyl
Ketone
Hetero_hetero
AAR-POS-d2a4d1df-1
LON-WEI-8f408cad-3
0.618
AAR-POS-d2a4d1df-22
0.618
MAR-TRE-6a44bbf2-52
0.618
BEN-DND-76ad4ac9-13
0.540
BEN-DND-03406596-5
0.540
SAD-SAT-f2e2579e-8
0.521
MAK-UNK-6435e6c2-1
0.518
BEN-DND-76ad4ac9-6
0.517
BEN-DND-76ad4ac9-2
0.500
BEN-DND-03ad4429-5
0.491
MAK-UNK-10dfa458-4
0.483
BEN-DND-03ad4429-7
0.483
MAK-UNK-10dfa458-26
0.475
BEN-DND-03ad4429-6
0.459
MAK-UNK-69bf97dd-10
0.456
MAK-UNK-3f402c2b-1
0.448
MAK-UNK-987948f6-15
0.438
BEN-DND-03ad4429-8
0.423
MAR-TRE-04c86cea-49
0.375
GIA-UNK-5ec6c2b8-4
0.361
JAR-KUA-8c13982c-2
0.354
MAR-TRE-fd17a9b8-16
0.343
DRR-IMP-dff87f5e-4
0.338
MAR-TRE-fd17a9b8-15
0.338
MAK-UNK-009ebe36-9
0.337
SAD-SAT-f2e2579e-3
0.333
MAT-POS-ee51dedd-2
0.328
AAR-POS-0daf6b7e-15
0.328
MAR-TRE-4b834d9a-65
0.325
NIM-UNI-05f93fcc-1
0.324
MAK-UNK-7c9d1431-12
0.324
MAK-UNK-7c9d1431-9
0.318
MAR-TRE-6a44bbf2-21
0.318
MAK-UNK-69bf97dd-3
0.318
MAR-TRE-fd17a9b8-42
0.315
LON-WEI-120e5cf5-5
0.314
MAK-UNK-c74072e5-8
0.314
PEI-IMP-ca0b2813-2
0.309
NIM-UNI-05f93fcc-3
0.308
NIM-UNI-05f93fcc-13
0.308
LON-WEI-8f408cad-2
0.304
AAR-POS-d2a4d1df-32
0.304
MAR-TRE-6a44bbf2-4
0.304
SAD-SAT-f2e2579e-5
0.304
AAR-POS-0daf6b7e-16
0.303
SAD-SAT-f2e2579e-9
0.302
GIA-UNK-eaadd1d4-3
0.301
BEN-DND-03406596-10
0.300
LON-WEI-8f408cad-4
0.300
MAR-TRE-fd17a9b8-64
0.300
AAR-POS-d2a4d1df-23
0.300
MAR-TRE-6a44bbf2-18
0.300
NIM-UNI-05f93fcc-2
0.299
NIM-UNI-310206f0-70
0.298
MAK-UNK-7c9d1431-19
0.297
SAD-SAT-9a6c5cf3-5
0.296
MAK-UNK-7c9d1431-17
0.296
PEI-IMP-ca0b2813-1
0.296
DRR-IMP-dff87f5e-6
0.296
NIM-UNI-310206f0-69
0.295
LON-WEI-8f408cad-5
0.294
DRR-IMP-dff87f5e-3
0.294
AAR-POS-d2a4d1df-44
0.294
SAD-SAT-9a6c5cf3-7
0.294
AAR-POS-0daf6b7e-17
0.294
SAD-SAT-9a6c5cf3-10
0.293
SAD-SAT-f2e2579e-10
0.293
DRR-IMP-dff87f5e-8
0.292
MAR-TRE-6a44bbf2-58
0.290
MAR-TRE-6a44bbf2-89
0.290
MAR-LAB-efb042c5-5
0.290
MAR-TRE-6a44bbf2-68
0.290
AAR-POS-d2a4d1df-27
0.290
KAY-MCD-d0fe5261-1
0.290
DRR-IMP-dff87f5e-1
0.290
SAD-SAT-3a925b8b-2
0.290
DRR-IMP-dff87f5e-7
0.290
PEI-IMP-ca0b2813-3
0.289
MAK-UNK-69bf97dd-9
0.289
YUN-WES-64c64eb2-1
0.288
YUN-WES-58b0dbae-2
0.288
AHN-SAT-de2502ba-19
0.288
GIA-UNK-995df016-12
0.288
NIM-UNI-05f93fcc-5
0.287
MAK-UNK-69bf97dd-1
0.287
MAR-TRE-fd17a9b8-22
0.286
MAK-UNK-212f693e-32
0.286
SAD-SAT-3a925b8b-3
0.286
MAR-TRE-6a44bbf2-78
0.286
MAK-UNK-7c9d1431-13
0.286
SAD-SAT-2fd372d1-1
0.286
MAC-MCD-4707377b-1
0.286
MAK-UNK-69bf97dd-8
0.286
NIM-UNI-05f93fcc-11
0.286
JAY-UNK-11f5bdbd-1
0.286
MAR-TRE-d0525fbf-90
0.286
MAR-TRE-fd17a9b8-50
0.284
AHN-SAT-de2502ba-6
0.284
MAR-TRE-6a44bbf2-43
0.284
MAR-TRE-fd17a9b8-92
0.283