Molecular Properties | |
SMILES: | O=C(CCl)N1CCN(S(=O)(=O)c2ccc(Cl)cc2)CC1 |
MW: | 337.228 |
Fraction sp3: | 0.42 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 57.69 |
cLogP: | 1.4117 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Enamine BB: | EN300-08173 |
Enamine SCR: | Z56949574 |
Enamine REAL: | Z56949574 |
Enamine Extended REAL: | m_270062____7595236____8147258 |
Mcule: | MCULE-4357480999 |
MolPort: | MolPort-002-465-805 |
Order Status | |
Shipped: | 2021-04-16 |
Activated haloaromatics
Hetero_hetero
AAR-POS-d2a4d1df-1
SAL-INS-1ea6d4ee-3
SAL-INS-1ea6d4ee-4
SAL-INS-1ea6d4ee-2
SAL-INS-1ea6d4ee-1
PED-UNI-a9f4e7c0-1
SEL-UNI-c5c112eb-2
SEL-UNI-c5c112eb-1
DRA-CSI-7ec17797-18
DRA-CSI-7ec17797-17
DRA-CSI-7ec17797-16
DRA-CSI-7ec17797-15
DRA-CSI-7ec17797-14
DRA-CSI-7ec17797-12
DRA-CSI-7ec17797-9
DRA-CSI-7ec17797-6
DRA-CSI-7ec17797-5
DRA-CSI-7ec17797-3
DRA-CSI-7ec17797-2
DRA-CSI-7ec17797-1
DRA-CSI-7ec17797-19
DRA-CSI-7ec17797-13
DRA-CSI-7ec17797-7
DRA-CSI-7ec17797-10
DRA-CSI-7ec17797-4
PED-UNI-b79f0f51-2
PED-UNI-b79f0f51-1
NAU-LAT-f723e322-6
NAU-LAT-f723e322-5
NAU-LAT-f723e322-2
NAU-LAT-f723e322-3
NAU-LAT-f723e322-1
NAU-LAT-f723e322-4
IND-SYN-3aa4e743-1
PAF-PIO-d312ccf6-4
PAF-PIO-d312ccf6-2
PAF-PIO-d312ccf6-3
PAF-PIO-d312ccf6-1
AAR-POS-d2a4d1df-44
1.000
DRR-IMP-dff87f5e-1
0.706
AAR-POS-d2a4d1df-27
0.706
DRR-IMP-dff87f5e-7
0.706
MAR-TRE-6a44bbf2-58
0.706
MAR-LAB-efb042c5-5
0.706
MAR-TRE-6a44bbf2-68
0.706
KAY-MCD-d0fe5261-1
0.706
MAK-UNK-7c9d1431-13
0.692
MAR-TRE-6a44bbf2-78
0.692
DRR-IMP-dff87f5e-6
0.667
DRR-IMP-dff87f5e-9
0.667
MAK-UNK-7c9d1431-17
0.667
MAK-UNK-c74072e5-8
0.667
MAK-UNK-7c9d1431-6
0.667
MAR-TRE-6a44bbf2-21
0.667
MAK-UNK-7c9d1431-9
0.667
MAK-UNK-7c9d1431-22
0.661
MAK-UNK-7c9d1431-10
0.655
PEI-IMP-ca0b2813-2
0.642
JAY-UNK-11f5bdbd-1
0.630
MAR-TRE-6a44bbf2-32
0.625
ABB-MCD-f8003a30-1
0.625
SAD-SAT-bc31ec01-5
0.623
SAD-SAT-3a925b8b-2
0.611
BAP-BUY-55f8bcae-1
0.610
DRR-IMP-dff87f5e-8
0.596
MAT-POS-ee51dedd-2
0.582
MAR-TRE-6a44bbf2-26
0.579
MAK-UNK-7c9d1431-8
0.579
SAD-SAT-bc31ec01-4
0.569
BEN-DND-03406596-8
0.567
BEN-DND-03406596-10
0.561
MAR-TRE-6a44bbf2-18
0.561
AAR-POS-d2a4d1df-23
0.561
LON-WEI-8f408cad-4
0.561
SAD-SAT-3a925b8b-9
0.554
PEI-IMP-ca0b2813-1
0.552
DRR-IMP-dff87f5e-4
0.545
MAK-UNK-7c9d1431-12
0.544
MAK-UNK-7c9d1431-19
0.541
AAR-POS-0daf6b7e-15
0.526
MAK-UNK-d4768348-4
0.526
MAK-UNK-d4768348-1
0.526
TAT-ENA-80bfd3e5-25
0.524
DRR-IMP-dff87f5e-2
0.524
MAK-UNK-7c9d1431-4
0.524
MAK-UNK-7c9d1431-3
0.524
MAK-UNK-d4768348-5
0.517
MAR-TRE-6a44bbf2-4
0.517
MAK-UNK-d4768348-8
0.517
LON-WEI-8f408cad-2
0.517
AAR-POS-d2a4d1df-32
0.517
TAT-ENA-80bfd3e5-43
0.516
MAR-TRE-6a44bbf2-65
0.516
MAK-UNK-7c9d1431-11
0.516
MAK-UNK-7c9d1431-7
0.516
MAR-TRE-6a44bbf2-49
0.516
MAK-UNK-7c9d1431-5
0.516
MAR-TRE-6a44bbf2-31
0.516
MAK-UNK-d4768348-7
0.508
MAK-UNK-7c9d1431-1
0.508
MAR-TRE-6a44bbf2-38
0.508
SAD-SAT-f2e2579e-5
0.507
IND-SYN-6c8299e8-2
0.500
DRR-IMP-db50bf6e-5
0.500
AAR-POS-d2a4d1df-22
0.500
MED-COV-4280ac29-5
0.500
PEI-IMP-ca0b2813-3
0.500
KAT-UNK-b2a0d5b1-1
0.500
LON-WEI-8f408cad-3
0.500
MAR-TRE-6a44bbf2-52
0.500
MAR-TRE-6a44bbf2-8
0.500
AAR-POS-d2a4d1df-34
0.500
DRR-IMP-dff87f5e-5
0.500
SAD-SAT-9a6c5cf3-5
0.493
NAU-LAT-f723e322-6
0.493
MAR-TRE-6a44bbf2-36
0.493
MAK-UNK-7c9d1431-2
0.493
NIM-UNI-05f93fcc-1
0.492
SAD-SAT-3a925b8b-3
0.492
SAD-SAT-3a925b8b-6
0.492
MAK-UNK-d4768348-2
0.492
SAD-SAT-f2e2579e-10
0.486
MAK-UNK-c74072e5-9
0.479
MAK-UNK-d4768348-9
0.469
SAD-SAT-3a925b8b-7
0.468
DRR-IMP-db50bf6e-3
0.464
MAK-UNK-7c9d1431-29
0.464
AAR-POS-d2a4d1df-36
0.460
RHE-UNK-eb059eb9-1
0.460
MAK-UNK-3f402c2b-15
0.460
AAR-POS-0daf6b7e-3
0.460
WAR-XCH-79d12f6e-6
0.460
MAR-TRE-6a44bbf2-13
0.460
SAD-SAT-9a6c5cf3-9
0.459
MAK-UNK-d4768348-3
0.459
BEN-DND-03406596-3
0.455
BEN-DND-76ad4ac9-14
0.455
MAR-TRE-6a44bbf2-45
0.448