Molecular Properties | |
SMILES: | CS(=O)(=O)c1ccc2c(NC(=O)C3CCS(=O)(=O)c4ccc(Cl)cc43)cncc2c1 |
MW: | 464.03 |
Fraction sp3: | 0.2 |
HBA: | 6 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 110.27 |
cLogP: | 3.19 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 0.744089673300504 |
Order Status | |
Ordered: | 2021-04-27 |
Synthesis Location: | enamine |
Shipped: | 2021-06-15 |
Activated haloaromatics
EDJ-MED-b7309adf-2
0.771
BEN-DND-f06bfa8e-5
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EDG-MED-f9979214-1
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EDJ-MED-93390d0c-1
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EDJ-MED-94fddcec-1
0.731
EDG-MED-f9979214-2
0.722
ALP-POS-6f6ae286-7
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PET-UNK-2c6614b6-5
0.719
EDJ-MED-b7309adf-1
0.719
MAT-POS-86c60949-1
0.719
BEN-DND-0ac71396-1
0.703
PET-UNK-2c6614b6-7
0.689
PET-UNK-09a29654-2
0.688
LUO-POS-868e8996-13
0.682
LUO-POS-868e8996-14
0.682
MAT-POS-66a736cf-1
0.682
MIC-UNK-91acba05-3
0.682
BEN-DND-0ac71396-2
0.681
PET-UNK-2c6614b6-9
0.674
EDJ-MED-f9b78f78-1
0.674
PET-UNK-2c6614b6-3
0.653
PET-UNK-09a29654-3
0.650
EDJ-MED-d9f3798e-3
0.649
PET-UNK-b38839dc-17
0.646
PET-UNK-7bb24635-5
0.646
PET-UNK-2c6614b6-8
0.641
PET-UNK-2c6614b6-6
0.641
PET-UNK-b38839dc-16
0.639
MAT-POS-7ddaf7de-2
0.638
ERI-UCB-8d4e5055-3
0.638
PET-UNK-09a29654-1
0.636
PET-UNK-7bb24635-6
0.635
PET-UNK-7bb24635-4
0.625
PET-UNK-2c6614b6-2
0.619
PET-UNK-b1ef24dc-16
0.596
PET-UNK-b38839dc-15
0.596
PET-UNK-7f7e354d-3
0.589
PET-UNK-b1ef24dc-15
0.589
PET-UNK-2c6614b6-1
0.588
PET-UNK-2c6614b6-4
0.583
PET-UNK-b1ef24dc-13
0.579
EDJ-MED-94fddcec-3
0.573
PET-UNK-b1ef24dc-14
0.567
EDJ-MED-94fddcec-2
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EDJ-MED-41558c53-10
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PET-UNK-c671f938-3
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PET-UNK-c671f938-7
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EDJ-MED-41558c53-8
0.541
EDJ-MED-70ab3faf-2
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EDJ-MED-0186a59b-7
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MAT-POS-2e8b2191-12
0.537
EDJ-MED-41558c53-12
0.533
EDJ-MED-d165ed91-5
0.532
EDJ-MED-e69ed63d-10
0.531
BEN-DND-f06bfa8e-4
0.530
EDJ-MED-c99b2211-4
0.527
EDJ-MED-e69ed63d-12
0.527
EDJ-MED-d165ed91-4
0.527
EDJ-MED-e69ed63d-4
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EDJ-MED-e69ed63d-8
0.523
EDJ-MED-ede277f6-12
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EDJ-MED-e69ed63d-16
0.522
EDJ-MED-211392e3-2
0.519
EDJ-MED-41558c53-2
0.519
EDJ-MED-d165ed91-1
0.519
EDJ-MED-41558c53-14
0.518
EDJ-MED-e69ed63d-2
0.518
PET-UNK-b78139fa-5
0.515
EDJ-MED-0186a59b-3
0.509
EDJ-MED-7889e8da-5
0.509
EDJ-MED-e69ed63d-14
0.509
EDJ-MED-c99b2211-3
0.509
EDJ-MED-f9b78f78-5
0.505
EDJ-MED-d165ed91-6
0.505
EDJ-MED-7889e8da-6
0.504
EDJ-MED-378a25ea-9
0.504
EDJ-MED-e69ed63d-5
0.504
EDJ-MED-d165ed91-3
0.504
EDJ-MED-41558c53-4
0.500
EDG-MED-b8f93667-4
0.500
TET-ENA-382364b7-1
0.500
EDJ-MED-d165ed91-2
0.500
EDJ-MED-ede277f6-8
0.500
EDJ-MED-e69ed63d-18
0.500
PET-UNK-158bee2a-11
0.500
EDJ-MED-41558c53-6
0.496
PET-UNK-3324058f-3
0.496
PET-UNK-3324058f-7
0.496
EDJ-MED-f9b78f78-2
0.495
MIC-UNK-8758c41d-1
0.495
MAT-POS-c88128cb-14
0.491
PET-UNK-b78139fa-6
0.490
PET-UNK-022eab87-1
0.490
EDJ-MED-ede277f6-6
0.487
MAT-POS-5c19d660-1
0.487
PET-UNK-6e612674-7
0.486
PET-UNK-6e612674-15
0.486
ERI-UCB-8d4e5055-4
0.485
BEN-DND-c852c98b-5
0.485
EDJ-MED-dd2a8363-2
0.485