Molecular Properties | |
SMILES: | O=C(Cc1cccc(Cl)c1)Nc1cncc2ccc(OC(F)(F)F)cc12 |
MW: | 380.05 |
Fraction sp3: | 0.11 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 51.22 |
cLogP: | 4.97 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2021-08-25 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
high halogen content (>3)
MAT-POS-90fd5f68-23
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PET-UNK-8df914d1-1
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EDJ-MED-00c1612e-1
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MAT-POS-90fd5f68-6
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PET-UNK-7fb4f80a-2
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MAT-POS-90fd5f68-31
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MAT-POS-90fd5f68-33
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RUB-POS-1325a9ea-4
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MAT-POS-90fd5f68-37
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MAT-POS-90fd5f68-40
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MAT-POS-90fd5f68-25
0.630
PET-UNK-d899bab6-1
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MAT-POS-90fd5f68-29
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MAT-POS-90fd5f68-19
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MAT-POS-90fd5f68-32
0.615
MAT-POS-90fd5f68-39
0.614
MAT-POS-90fd5f68-22
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MAT-POS-90fd5f68-20
0.602
MAT-POS-90fd5f68-34
0.596
MAT-POS-90fd5f68-36
0.593
ADA-UCB-6c2cb422-1
0.590
MAT-POS-90fd5f68-35
0.588
MAT-POS-90fd5f68-27
0.588
MAT-POS-90fd5f68-21
0.588
MAT-POS-f7918075-5
0.588
MAT-POS-90fd5f68-28
0.586
MAT-POS-90fd5f68-30
0.581
MAT-POS-29385cc1-1
0.570
PET-UNK-b38839dc-1
0.570
MAT-POS-c20a539d-7
0.568
MAT-POS-c20a539d-2
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MAT-POS-bb423b95-1
0.562
MAT-POS-90fd5f68-5
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MAT-POS-90fd5f68-26
0.562
MAT-POS-29385cc1-2
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MAT-POS-c20a539d-1
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PET-UNK-b38839dc-2
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PET-UNK-f4e47ebd-1
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JIN-POS-6dc588a4-11
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PET-UNK-d899bab6-2
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MAT-POS-29385cc1-3
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MAT-POS-c20a539d-6
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MAT-POS-bb423b95-8
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MAT-POS-90fd5f68-38
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PET-UNK-d899bab6-3
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PET-UNK-7fb4f80a-3
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PET-UNK-c6bcc80b-7
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PET-UNK-7fb4f80a-1
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PET-UNK-7fb4f80a-4
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RUB-POS-1325a9ea-13
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MAT-POS-90fd5f68-4
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MAT-POS-90fd5f68-7
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MAT-POS-c20a539d-4
0.517
MAT-POS-c0609ef7-1
0.517
MAT-POS-c20a539d-3
0.517
MAK-UNK-ffc90da7-6
0.515
EDJ-MED-c5ca5386-1
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MAT-POS-90fd5f68-41
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PET-UNK-f4e47ebd-2
0.511
MAT-POS-90fd5f68-11
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PET-UNK-bb7ffe78-2
0.511
MAT-POS-90fd5f68-13
0.511
MIC-UNK-7574fcc6-1
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MAT-POS-90fd5f68-1
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MAT-POS-90fd5f68-2
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JIN-POS-6dc588a4-13
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PET-UNK-6314f867-2
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MAT-POS-c20a539d-8
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MAT-POS-90fd5f68-15
0.500
MAT-POS-c20a539d-5
0.500
MAT-POS-90fd5f68-12
0.495
MAT-POS-29385cc1-4
0.494
MIC-UNK-668ac5de-1
0.494
PET-UNK-b1ef24dc-4
0.494
PET-UNK-b1ef24dc-3
0.494
MAT-POS-90fd5f68-10
0.489
MAT-POS-90fd5f68-18
0.489
JOH-UNI-ee5ed7c8-3
0.489
JOH-UNI-3fc3434e-3
0.489
MAT-POS-f7918075-3
0.488
MIC-UNK-08cd9c58-1
0.488
MAT-POS-bb423b95-9
0.488
BEN-DND-c852c98b-2
0.485
MAT-POS-90fd5f68-8
0.484
MAT-POS-90fd5f68-3
0.484
MAT-POS-90fd5f68-17
0.484
MIC-UNK-9dc9fcd1-1
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MAT-POS-90fd5f68-9
0.484
EDJ-MED-c5ca5386-2
0.483
JIN-POS-6dc588a4-18
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JIN-POS-6dc588a4-6
0.482
JIN-POS-6dc588a4-22
0.482
PET-UNK-e274cad4-6
0.482
PET-UNK-7f7e354d-7
0.482
MAT-POS-90fd5f68-14
0.480
MIC-UNK-9dc9fcd1-3
0.479
MIC-UNK-fbef42b7-1
0.479
RUB-POS-1325a9ea-5
0.477
MAT-POS-bb423b95-2
0.477
RUB-POS-1325a9ea-2
0.477