Molecular Properties | |
SMILES: | CC(C)(C)c1cnc(N(C(=O)c2cocn2)C(C(=O)NCCc2cccc(F)c2)c2cccnc2)o1 |
MW: | 491.2 |
Fraction sp3: | 0.27 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 8 |
TPSA: | 114.36 |
cLogP: | 4.24 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 32.434483068324 |
Order Status | |
Shipped: | synthesis in progress |
Long aliphatic chain
ALP-POS-95f71980-16
0.758
ALP-POS-02c6a514-50
0.735
ALP-POS-ced8ea4d-28
0.704
ALP-UNI-fe744232-18
0.703
ALP-POS-95f71980-20
0.699
ALP-POS-ced8ea4d-37
0.696
ALP-POS-95f71980-5
0.692
ALP-POS-95f71980-39
0.692
ALP-POS-95f71980-8
0.692
ALP-POS-ced8ea4d-27
0.690
ALP-POS-95f71980-40
0.689
ALP-POS-95f71980-12
0.686
ALP-POS-95f71980-9
0.683
ALP-POS-95f71980-36
0.683
ALP-POS-95f71980-1
0.683
ALP-POS-95f71980-41
0.679
ALP-POS-ced8ea4d-9
0.676
ALP-POS-95f71980-31
0.676
ALP-POS-95f71980-37
0.676
ALP-POS-ced8ea4d-62
0.676
ALP-POS-ced8ea4d-19
0.670
ALP-POS-ced8ea4d-63
0.667
ALP-POS-ced8ea4d-16
0.664
ALP-POS-ced8ea4d-67
0.663
ALP-UNI-fe744232-3
0.663
ALP-UNI-fe744232-14
0.657
ALP-POS-ced8ea4d-11
0.657
ALP-POS-ced8ea4d-52
0.657
ALP-POS-ced8ea4d-5
0.657
ALP-POS-ced8ea4d-39
0.657
ALP-POS-ced8ea4d-49
0.657
ALP-POS-95f71980-13
0.657
ALP-UNI-fe744232-15
0.654
ALP-POS-ced8ea4d-12
0.651
ALP-UNI-fe744232-9
0.651
ALP-POS-ced8ea4d-51
0.651
ALP-UNI-fe744232-17
0.648
ALP-UNI-fe744232-12
0.645
ALP-POS-ced8ea4d-59
0.642
ALP-UNI-fe744232-22
0.639
ALP-UNI-fe744232-30
0.639
ALP-POS-ced8ea4d-7
0.634
ALP-POS-ced8ea4d-44
0.633
ALP-UNI-fe744232-1
0.633
ALP-POS-95f71980-3
0.633
ALP-POS-ced8ea4d-13
0.632
ALP-POS-ced8ea4d-22
0.632
ALP-POS-ced8ea4d-53
0.631
ALP-POS-ced8ea4d-17
0.631
ALP-UNI-fe744232-19
0.631
ALP-POS-ced8ea4d-21
0.625
ALP-POS-95f71980-10
0.625
ALP-POS-ced8ea4d-36
0.625
ALP-POS-ced8ea4d-18
0.623
ALP-POS-95f71980-30
0.623
ALP-UNI-fe744232-11
0.622
ALP-POS-ced8ea4d-10
0.622
ALP-POS-ced8ea4d-34
0.622
ALP-POS-ced8ea4d-50
0.619
ALP-POS-95f71980-35
0.619
ALP-POS-ced8ea4d-24
0.616
ALP-POS-ced8ea4d-35
0.616
ALP-POS-ced8ea4d-38
0.616
ALP-POS-ced8ea4d-20
0.616
ALP-POS-95f71980-26
0.616
ALP-POS-ced8ea4d-64
0.615
ALP-POS-ced8ea4d-65
0.614
ALP-POS-95f71980-38
0.612
ALP-POS-ced8ea4d-25
0.612
ALP-UNI-fe744232-25
0.611
ALP-POS-ced8ea4d-8
0.611
ALP-POS-95f71980-33
0.611
ALP-UNI-fe744232-13
0.605
ALP-POS-ced8ea4d-47
0.605
ALP-POS-95f71980-28
0.605
ALP-POS-95f71980-34
0.605
ALP-POS-95f71980-27
0.605
ALP-POS-95f71980-32
0.603
ALP-POS-ced8ea4d-15
0.600
ALP-POS-ced8ea4d-54
0.598
ALP-POS-ced8ea4d-66
0.591
ALP-POS-d0876c20-17
0.590
ALP-POS-ced8ea4d-32
0.590
ALP-POS-95f71980-15
0.590
ALP-POS-ced8ea4d-41
0.587
ALP-POS-ced8ea4d-2
0.586
ALP-POS-d0876c20-5
0.585
ALP-POS-ced8ea4d-1
0.585
ALP-POS-ced8ea4d-14
0.580
ALP-POS-305f6ec3-12
0.577
LON-WEI-babf2c61-10
0.575
ALP-POS-ced8ea4d-45
0.575
MAT-POS-f2460aef-3
0.574
ALP-POS-95f71980-24
0.574
ALP-POS-d0876c20-21
0.574
ALP-POS-ced8ea4d-29
0.570
ALP-POS-ced8ea4d-56
0.570
ALP-POS-95f71980-4
0.570
ALP-POS-ced8ea4d-42
0.569
ALP-POS-ced8ea4d-58
0.566