Molecular Properties | |
SMILES: | CC(C)(C)c1ccc(N(C(=O)c2cocn2)C(C(=O)NC2CCOC2)c2cccnc2)cc1 |
MW: | 448.21 |
Fraction sp3: | 0.36 |
HBA: | 6 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 97.56 |
cLogP: | 3.66 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 2.76689975514448 |
Order Status | |
Shipped: | synthesis in progress |
ALP-POS-88a7a97e-34
0.835
ALP-POS-88a7a97e-9
0.830
ALP-POS-88a7a97e-12
0.812
ALP-POS-88a7a97e-45
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ALP-POS-88a7a97e-28
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ALP-POS-88a7a97e-26
0.753
ALP-POS-88a7a97e-39
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ALP-POS-88a7a97e-15
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ALP-POS-88a7a97e-1
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ALP-POS-88a7a97e-6
0.697
ALP-POS-88a7a97e-43
0.694
ALP-POS-88a7a97e-14
0.693
ALP-POS-88a7a97e-18
0.685
ALP-POS-88a7a97e-25
0.680
ALP-POS-88a7a97e-35
0.678
ALP-POS-88a7a97e-7
0.678
ALP-POS-88a7a97e-31
0.660
ALP-POS-88a7a97e-27
0.657
ALP-POS-88a7a97e-10
0.656
ALP-POS-88a7a97e-33
0.656
ALP-POS-88a7a97e-2
0.656
ALP-POS-88a7a97e-22
0.656
ALP-POS-88a7a97e-32
0.653
ALP-POS-88a7a97e-16
0.649
ALP-POS-88a7a97e-3
0.635
ALP-POS-88a7a97e-29
0.635
ALP-POS-88a7a97e-46
0.635
ALP-POS-88a7a97e-4
0.635
ALP-POS-88a7a97e-38
0.635
ALP-POS-88a7a97e-47
0.634
ALP-POS-88a7a97e-5
0.629
ALP-POS-88a7a97e-24
0.624
ALP-POS-88a7a97e-37
0.624
ALP-POS-88a7a97e-40
0.624
ALP-POS-88a7a97e-23
0.624
ALP-POS-88a7a97e-8
0.622
ALP-POS-88a7a97e-11
0.620
ALP-POS-88a7a97e-19
0.616
ALP-POS-88a7a97e-17
0.616
ALP-POS-88a7a97e-13
0.610
ALP-POS-88a7a97e-36
0.608
ALP-POS-88a7a97e-42
0.608
ALP-POS-88a7a97e-48
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ALP-POS-02c6a514-50
0.602
ALP-POS-88a7a97e-41
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ALP-POS-42f3de95-2
0.598
ALP-POS-88a7a97e-21
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ALP-POS-42f3de95-1
0.592
ALP-POS-88a7a97e-44
0.575
BRU-THA-40a53a3c-1
0.574
ALP-POS-88a7a97e-49
0.560
ALP-POS-42f3de95-3
0.555
ALP-POS-ced8ea4d-32
0.547
ALP-UNI-fe744232-18
0.546
LON-WEI-adc59df6-39
0.540
ALP-POS-88a7a97e-20
0.535
ALP-POS-95f71980-36
0.532
LON-WEI-adc59df6-19
0.529
ALP-POS-ced8ea4d-62
0.513
LON-WEI-adc59df6-14
0.510
LON-WEI-adc59df6-44
0.505
LON-WEI-adc59df6-35
0.500
ALP-POS-84f19ead-2
0.500
ALP-UNI-fe744232-13
0.496
ALP-POS-ced8ea4d-17
0.492
ALP-UNI-fe744232-10
0.491
ALP-POS-ced8ea4d-27
0.491
LON-WEI-adc59df6-8
0.490
ALP-POS-ced8ea4d-67
0.487
ALP-UNI-fe744232-11
0.483
ALP-UNI-fe744232-22
0.483
ALP-POS-ced8ea4d-9
0.482
ALP-POS-d0876c20-5
0.482
ALP-UNI-fe744232-17
0.479
ALP-POS-ced8ea4d-16
0.479
ALP-UNI-fe744232-9
0.478
ALP-POS-ced8ea4d-19
0.478
ALP-UNI-fe744232-21
0.474
ALP-POS-95f71980-37
0.474
ALP-UNI-fe744232-3
0.474
ALP-UNI-fe744232-16
0.473
ALP-UNI-fe744232-24
0.473
ALP-POS-ced8ea4d-28
0.473
ALP-POS-d0876c20-17
0.473
ALP-POS-95f71980-34
0.471
ALP-UNI-fe744232-15
0.470
ALP-UNI-fe744232-14
0.470
ALP-POS-ced8ea4d-49
0.470
ALP-POS-ced8ea4d-52
0.470
ALP-POS-ced8ea4d-5
0.470
ALP-POS-ced8ea4d-11
0.470
ALP-UNI-fe744232-5
0.469
ALP-POS-95f71980-3
0.466
ALP-POS-ced8ea4d-51
0.466
ALP-POS-ced8ea4d-12
0.466
ALP-UNI-fe744232-6
0.465
ALP-UNI-fe744232-27
0.465
ALP-POS-780445ae-1
0.465
ALP-UNI-fe744232-7
0.465
ALP-POS-95f71980-10
0.463