Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(S(=O)(=O)c2ccccc2F)CC1 |
MW: | 320.773 |
Fraction sp3: | 0.42 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 0.8974 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Enamine BB: | EN300-22584 |
Enamine SCR: | Z147647392 |
Enamine REAL: | Z212045176 |
Mcule: | MCULE-2374438362 |
MolPort: | MolPort-002-470-544 |
Activated haloaromatics
Hetero_hetero
MAR-TRE-6a44bbf2-8
1.000
BEN-DND-76ad4ac9-11
0.818
SAD-SAT-9a6c5cf3-10
0.714
MAK-UNK-7c9d1431-12
0.643
LON-WEI-8f408cad-2
0.586
MAR-TRE-6a44bbf2-4
0.586
AAR-POS-d2a4d1df-32
0.586
AAR-POS-d2a4d1df-37
0.581
MAR-TRE-6a44bbf2-7
0.581
SAD-SAT-bc31ec01-10
0.563
MAK-UNK-7c9d1431-9
0.534
MAR-TRE-6a44bbf2-21
0.534
LON-WEI-8f408cad-4
0.525
MAR-TRE-6a44bbf2-18
0.525
AAR-POS-d2a4d1df-23
0.525
BEN-DND-76ad4ac9-12
0.523
KAY-MCD-d0fe5261-1
0.517
MAR-TRE-6a44bbf2-58
0.517
ABB-MCD-f8003a30-1
0.508
MAR-TRE-6a44bbf2-32
0.508
MAK-UNK-7c9d1431-10
0.508
AAR-POS-d2a4d1df-36
0.500
AAR-POS-d2a4d1df-44
0.500
WAR-XCH-79d12f6e-6
0.500
MAR-TRE-6a44bbf2-13
0.500
AAR-POS-0daf6b7e-3
0.500
BEN-DND-76ad4ac9-10
0.493
MAR-TRE-6a44bbf2-52
0.492
LON-WEI-8f408cad-3
0.492
AAR-POS-d2a4d1df-22
0.492
MAK-UNK-3f402c2b-11
0.485
MAK-UNK-7c9d1431-11
0.485
MAR-TRE-6a44bbf2-65
0.485
TAT-ENA-80bfd3e5-43
0.485
BEN-DND-76ad4ac9-14
0.471
IND-SYN-6c8299e8-2
0.471
AAR-POS-d2a4d1df-27
0.468
AAR-POS-0daf6b7e-15
0.468
MAR-TRE-6a44bbf2-68
0.468
MAR-LAB-efb042c5-5
0.468
SAD-SAT-3a925b8b-2
0.468
MAT-POS-ee51dedd-2
0.468
MAK-UNK-c74072e5-4
0.468
SAD-SAT-5b1897b2-10
0.467
MAR-TRE-6a44bbf2-45
0.464
MAK-UNK-7c9d1431-30
0.464
MAT-POS-590ac91e-70
0.463
SAD-SAT-f2e2579e-6
0.461
NAU-LAT-f723e322-5
0.461
NIM-UNI-05f93fcc-1
0.460
SAD-SAT-3a925b8b-6
0.460
MAR-TRE-6a44bbf2-78
0.460
MAK-UNK-7c9d1431-13
0.460
SAD-SAT-bc31ec01-5
0.452
TAT-ENA-80bfd3e5-25
0.449
MAK-UNK-7c9d1431-3
0.449
MAK-UNK-7c9d1431-4
0.449
MAR-TRE-6a44bbf2-26
0.446
MAK-UNK-7c9d1431-6
0.446
MAK-UNK-7c9d1431-17
0.446
MAK-UNK-7c9d1431-8
0.446
MAK-UNK-c74072e5-8
0.446
MAK-UNK-d4768348-1
0.444
SAD-SAT-3a925b8b-9
0.444
NIM-UNI-05f93fcc-3
0.444
MAK-UNK-d4768348-4
0.444
SAD-SAT-3a925b8b-3
0.438
MAK-UNK-d4768348-8
0.438
MAR-TRE-6a44bbf2-28
0.438
MAK-UNK-d4768348-2
0.438
MAK-UNK-7c9d1431-23
0.438
MAK-UNK-d4768348-5
0.438
NIM-UNI-05f93fcc-2
0.437
SAD-SAT-f2e2579e-4
0.436
BEN-DND-76ad4ac9-13
0.435
MAK-UNK-d4768348-7
0.431
MAK-UNK-d4768348-3
0.431
MAK-UNK-7c9d1431-22
0.426
MAK-UNK-7c9d1431-27
0.424
GIA-UNK-7337c2f3-6
0.420
MAK-UNK-7c9d1431-19
0.420
SAD-SAT-3a925b8b-7
0.418
SAD-SAT-bc31ec01-4
0.418
SWA-SYN-6423ea73-2
0.412
SWA-SYN-d2e6fa14-2
0.412
MAR-TRE-6a44bbf2-24
0.409
MAK-UNK-7c9d1431-7
0.403
MAR-TRE-6a44bbf2-49
0.403
NIM-UNI-05f93fcc-11
0.403
MAK-UNK-7c9d1431-5
0.403
MAR-TRE-6a44bbf2-31
0.403
MED-COV-4280ac29-5
0.400
MAK-UNK-d4768348-9
0.400
MAK-UNK-c74072e5-9
0.400
NIM-UNI-310206f0-67
0.400
NIM-UNI-05f93fcc-5
0.400
MAK-UNK-7c9d1431-1
0.397
MAR-TRE-6a44bbf2-38
0.397
JAG-SYN-9c2cd0bd-13
0.397
AHN-SAT-de2502ba-15
0.397