Molecular Properties | |
SMILES: | O=C(/C=C/c1ccccc1)N1CCN(S(=O)(=O)c2cccs2)CC1 |
MW: | 362.08 |
Fraction sp3: | 0.24 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 4 |
TPSA: | 57.69 |
cLogP: | 2.29 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2021-07-07 |
Hetero_hetero
vinyl michael acceptor1
phenylethene
BEN-DND-03ad4429-7
0.613
MAK-UNK-10dfa458-4
0.613
MAR-TRE-6a44bbf2-52
0.587
LON-WEI-8f408cad-3
0.587
AAR-POS-d2a4d1df-22
0.587
BEN-DND-03ad4429-4
0.562
MAK-UNK-6435e6c2-1
0.548
MAK-UNK-10dfa458-26
0.530
BEN-DND-76ad4ac9-13
0.521
BEN-DND-03406596-5
0.521
NAU-LAT-64f4b287-1
0.443
BEN-DND-76ad4ac9-1
0.423
BEN-DND-03ad4429-5
0.409
SAD-SAT-f2e2579e-8
0.402
MAK-UNK-7c9d1431-27
0.392
JAR-KUA-8c13982c-2
0.372
BEN-DND-03ad4429-6
0.370
PEI-IMP-3d837503-2
0.366
MAR-TRE-6a44bbf2-21
0.361
MAK-UNK-7c9d1431-9
0.361
NAU-LAT-64f4b287-2
0.356
NIM-UNI-05f93fcc-2
0.354
NAU-LAT-f723e322-6
0.349
DRR-IMP-dff87f5e-4
0.342
AAR-POS-0daf6b7e-15
0.333
NIM-UNI-05f93fcc-13
0.329
NIM-UNI-05f93fcc-1
0.329
YUN-WES-64c64eb2-1
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YUN-WES-58b0dbae-2
0.328
TAT-ENA-80bfd3e5-2
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MAK-UNK-10dfa458-18
0.320
MAK-UNK-3f402c2b-1
0.317
JAG-SYN-9c2cd0bd-1
0.316
MAT-POS-ee51dedd-2
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NIM-UNI-05f93fcc-3
0.314
MAK-UNK-69bf97dd-10
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SAD-SAT-2fd372d1-1
0.312
AAR-POS-d2a4d1df-32
0.312
LON-WEI-8f408cad-2
0.312
MAR-TRE-6a44bbf2-4
0.312
MAK-UNK-7c9d1431-12
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DAV-SYG-f22c749d-11
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PEI-IMP-3d837503-4
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MAK-UNK-987948f6-15
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DRR-IMP-dff87f5e-5
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AAR-POS-d2a4d1df-34
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MAR-TRE-6a44bbf2-8
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NIM-UNI-310206f0-69
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TAT-ENA-80bfd3e5-11
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PEI-IMP-ca0b2813-2
0.299
AAR-POS-d2a4d1df-27
0.299
MAR-LAB-efb042c5-5
0.299
MAR-TRE-6a44bbf2-68
0.299
DAV-SYG-f22c749d-12
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PEI-IMP-668afc53-2
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NIM-UNI-05f93fcc-7
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NIM-UNI-05f93fcc-5
0.295
SAD-SAT-65574d3f-1
0.295
AHN-SAT-de2502ba-14
0.295
MAK-UNK-7c9d1431-23
0.295
MAR-TRE-6a44bbf2-28
0.295
DAV-IMP-59dd6621-12
0.294
NIM-UNI-05f93fcc-11
0.294
TAT-ENA-80bfd3e5-29
0.291
LON-WEI-8f408cad-4
0.291
BEN-DND-03ad4429-3
0.291
MAR-TRE-6a44bbf2-18
0.291
MAK-UNK-10dfa458-5
0.291
AAR-POS-d2a4d1df-23
0.291
BEN-DND-03406596-10
0.291
NIM-UNI-310206f0-70
0.290
MAR-TRE-6a44bbf2-7
0.289
AAR-POS-d2a4d1df-37
0.289
NIM-UNI-05f93fcc-6
0.289
NIM-UNI-05f93fcc-10
0.289
NIM-UNI-05f93fcc-15
0.289
TOB-UNK-c2aba166-4
0.287
MAK-UNK-7c9d1431-17
0.287
DRR-IMP-dff87f5e-6
0.287
PEI-IMP-ca0b2813-1
0.287
NIM-UNI-05f93fcc-14
0.287
MAR-TRE-04c86cea-49
0.287
DRR-IMP-db50bf6e-4
0.286
DRR-IMP-dff87f5e-3
0.286
AAR-POS-d2a4d1df-44
0.286
ABB-MCD-f8003a30-1
0.284
MAR-TRE-6a44bbf2-32
0.284
DRR-IMP-dff87f5e-8
0.284
PEI-IMP-ca0b2813-3
0.282
BEN-DND-76ad4ac9-11
0.282
BEN-DND-03406596-9
0.282
DRR-IMP-dff87f5e-2
0.282
MAK-UNK-7c9d1431-3
0.282
SAD-SAT-3a925b8b-2
0.282
DRR-IMP-db50bf6e-5
0.282
DRR-IMP-dff87f5e-1
0.282
DRR-IMP-dff87f5e-7
0.282
KAY-MCD-d0fe5261-1
0.282
MAR-TRE-6a44bbf2-58
0.282
NIM-UNI-310206f0-67
0.281