Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Br)cc2)CC1 |
MW: | 379.96 |
Fraction sp3: | 0.42 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 1.52 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activated haloaromatics
Filter9_metal
aryl bromide
Hetero_hetero
MAK-UNK-7c9d1431-9
DRR-IMP-dff87f5e-3
0.706
AAR-POS-d2a4d1df-44
0.706
MAR-TRE-6a44bbf2-68
0.692
DRR-IMP-dff87f5e-1
0.692
MAR-TRE-6a44bbf2-58
0.692
MAR-LAB-efb042c5-5
0.692
AAR-POS-d2a4d1df-27
0.692
KAY-MCD-d0fe5261-1
0.692
MAR-TRE-6a44bbf2-78
0.679
MAK-UNK-7c9d1431-13
0.679
MAK-UNK-7c9d1431-6
0.655
MAK-UNK-7c9d1431-17
0.655
DRR-IMP-dff87f5e-6
0.655
DRR-IMP-dff87f5e-9
0.655
MAK-UNK-c74072e5-8
0.655
MAR-TRE-6a44bbf2-21
0.654
MAK-UNK-7c9d1431-9
0.654
PEI-IMP-ca0b2813-2
0.630
BAP-BUY-55f8bcae-1
0.627
MAK-UNK-7c9d1431-22
0.621
JAY-UNK-11f5bdbd-1
0.618
SAD-SAT-3a925b8b-2
0.600
MAT-POS-ee51dedd-2
0.571
MAR-TRE-6a44bbf2-26
0.569
MAK-UNK-7c9d1431-8
0.569
ABB-MCD-f8003a30-1
0.559
MAR-TRE-6a44bbf2-32
0.559
MAK-UNK-7c9d1431-10
0.559
BEN-DND-03406596-8
0.557
SAD-SAT-bc31ec01-5
0.554
MAR-TRE-6a44bbf2-18
0.552
AAR-POS-d2a4d1df-23
0.552
LON-WEI-8f408cad-4
0.552
BEN-DND-03406596-10
0.552
DRR-IMP-db50bf6e-5
0.544
PEI-IMP-ca0b2813-1
0.542
NIM-UNI-05f93fcc-1
0.534
DRR-IMP-dff87f5e-8
0.533
MAK-UNK-7c9d1431-19
0.532
SAD-SAT-3a925b8b-9
0.517
MAK-UNK-d4768348-1
0.517
MAK-UNK-d4768348-4
0.517
DRR-IMP-dff87f5e-2
0.516
MAK-UNK-7c9d1431-4
0.516
MAK-UNK-7c9d1431-3
0.516
TAT-ENA-80bfd3e5-25
0.516
DRR-IMP-dff87f5e-4
0.509
MAK-UNK-d4768348-8
0.508
MAK-UNK-d4768348-5
0.508
SAD-SAT-bc31ec01-4
0.508
MAR-TRE-6a44bbf2-65
0.508
TAT-ENA-80bfd3e5-43
0.508
MAK-UNK-7c9d1431-11
0.508
MAK-UNK-7c9d1431-5
0.508
MAK-UNK-7c9d1431-7
0.508
MAR-TRE-6a44bbf2-49
0.508
MAR-TRE-6a44bbf2-31
0.508
SAD-SAT-f2e2579e-5
0.500
MAK-UNK-d4768348-7
0.500
MAK-UNK-7c9d1431-1
0.500
MAR-TRE-6a44bbf2-38
0.500
MED-COV-4280ac29-5
0.493
IND-SYN-6c8299e8-2
0.492
PEI-IMP-ca0b2813-3
0.492
MAR-TRE-6a44bbf2-52
0.492
LON-WEI-8f408cad-3
0.492
AAR-POS-0daf6b7e-15
0.492
AAR-POS-d2a4d1df-22
0.492
SAD-SAT-9a6c5cf3-5
0.486
MAR-TRE-6a44bbf2-36
0.485
MAK-UNK-7c9d1431-2
0.485
SAD-SAT-3a925b8b-3
0.483
LON-WEI-8f408cad-2
0.483
MAK-UNK-7c9d1431-12
0.483
MAK-UNK-d4768348-2
0.483
AAR-POS-d2a4d1df-32
0.483
MAR-TRE-6a44bbf2-4
0.483
SAD-SAT-f2e2579e-10
0.479
MAK-UNK-d4768348-3
0.475
AAR-POS-d2a4d1df-34
0.468
DRR-IMP-dff87f5e-5
0.468
MAR-TRE-6a44bbf2-8
0.468
MAK-UNK-d4768348-9
0.462
SAD-SAT-3a925b8b-6
0.459
SAD-SAT-9a6c5cf3-9
0.453
MAR-TRE-6a44bbf2-13
0.453
WAR-XCH-79d12f6e-6
0.453
AAR-POS-0daf6b7e-3
0.453
RHE-UNK-eb059eb9-1
0.453
AAR-POS-d2a4d1df-36
0.453
BEN-DND-03406596-3
0.448
BEN-DND-76ad4ac9-14
0.448
KAT-UNK-b2a0d5b1-1
0.446
DAV-UNK-07f953a2-3
0.442
MAR-TRE-6a44bbf2-45
0.441
MAK-UNK-7c9d1431-30
0.441
SAD-SAT-9a6c5cf3-2
0.440
MAR-TRE-6a44bbf2-7
0.439
AAR-POS-d2a4d1df-37
0.439
SAD-SAT-3a925b8b-7
0.438