Molecular Properties | |
SMILES: | O=C(Nc1[nH]nc2ccccc12)C1CCOc2ccc(Cl)cc21 |
MW: | 327.08 |
Fraction sp3: | 0.18 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 2 |
TPSA: | 67.01 |
cLogP: | 3.72 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.5 |
IC50 (µM) - RapidFire: | 99.0 |
Order Status | |
Ordered: | 2020-09-29 |
Synthesis Location: | enamine |
Shipped: | 2020-11-04 |
VLA-UCB-1dbca3b4-15
JAG-UCB-52b62a6f-9
0.707
JAG-UCB-52b62a6f-12
0.682
JAG-UCB-52b62a6f-4
0.679
JAG-UCB-52b62a6f-8
0.663
VLA-UNK-0ffe3317-1
0.624
JAG-UCB-52b62a6f-7
0.621
PET-UNK-158bee2a-5
0.619
VLA-UNK-0ffe3317-7
0.619
JAG-UCB-52b62a6f-17
0.609
JAG-UCB-52b62a6f-5
0.602
JOH-UNI-1b27fa5e-1
0.578
JOH-UNI-1b27fa5e-4
0.571
JOH-SUS-a69c159d-6
0.562
EDJ-MED-ba7e64f2-2
0.556
JOH-UNI-f51e3bbc-1
0.556
NAU-LAT-8502cac5-12
0.545
ERI-UCB-9c7ec71b-2
0.545
EDJ-MED-e9694d2b-1
0.545
VLA-UCB-1dbca3b4-15
0.544
MAT-POS-b3e365b9-1
0.544
MAT-POS-b3e365b9-2
0.544
MAT-POS-f7918075-1
0.544
VLA-UCB-53bdeed6-2
0.540
ADA-UCB-dc2b944c-12
0.538
JOH-SUS-a69c159d-1
0.538
JOH-SUS-a69c159d-2
0.538
ADA-UCB-dc2b944c-10
0.538
EDJ-MED-ba7e64f2-3
0.538
BEN-DND-b89db3f2-1
0.533
VLA-UCB-05e51b3f-18
0.533
VLA-UCB-50c39ae8-11
0.533
ADA-UCB-dc2b944c-11
0.533
FRA-DIA-e29753f2-1
0.533
NAU-LAT-b7d8c353-3
0.533
JAG-UCB-c61058a9-45
0.533
JAG-UCB-c61058a9-6
0.529
VLA-UCB-53bdeed6-3
0.528
JAN-GHE-f4ca5a00-2
0.527
RAL-THA-b00e3cbf-1
0.527
JOH-SUS-a69c159d-3
0.527
VLA-UCB-05e51b3f-19
0.527
VLA-UCB-50c39ae8-12
0.527
JAG-UCB-52b62a6f-16
0.527
JOH-SUS-a69c159d-4
0.527
JOH-UNI-1b27fa5e-2
0.527
JOH-UNI-1b27fa5e-3
0.527
ROB-UNI-569bc02e-3
0.522
ROB-UNI-569bc02e-5
0.522
ADA-UCB-dc2b944c-9
0.521
JOH-UNI-f51e3bbc-3
0.521
JOH-UNI-f51e3bbc-4
0.521
RAL-THA-b74298ba-1
0.517
JAG-UCB-c61058a9-9
0.517
JOH-UNI-f51e3bbc-2
0.516
JOH-UNI-16fcdf60-1
0.511
VLA-UCB-05e51b3f-20
0.511
VLA-UCB-50c39ae8-13
0.511
MIC-UNK-42806bd5-4
0.506
PET-UNK-158bee2a-7
0.506
BRU-CON-c4e3408a-1
0.506
MAT-POS-b3e365b9-3
0.506
MAT-POS-b3e365b9-4
0.506
DAR-DIA-6a508060-6
0.506
JAN-GHE-f4ca5a00-13
0.506
NAU-LAT-8502cac5-13
0.505
JAG-UCB-52b62a6f-18
0.505
ALP-POS-ce760d3f-4
0.505
EDJ-MED-eff36d94-1
0.505
JAG-UCB-52b62a6f-19
0.505
ADA-UCB-b1b30a00-6
0.500
NAU-LAT-b7d8c353-4
0.500
RAL-THA-3d7a794f-4
0.500
BEN-DND-b89db3f2-2
0.500
JAG-UCB-c61058a9-7
0.500
NAU-LAT-8502cac5-10
0.500
MAT-POS-14f31916-5
0.500
JAG-UCB-c61058a9-22
0.500
TAT-ENA-0e28ea53-1
0.500
JAG-UCB-52b62a6f-13
0.495
ADA-UCB-dc2b944c-8
0.495
BEN-DND-02317c5c-3
0.495
MAT-POS-51833a24-1
0.495
PET-UNK-b1ef24dc-7
0.495
JAN-GHE-f4ca5a00-1
0.495
LON-WEI-0a73fcb8-7
0.495
LON-WEI-0a73fcb8-6
0.495
MAT-POS-a3f7f96a-2
0.494
MIC-UNK-fc94cdb5-2
0.494
ALF-EVA-5b152d2f-5
0.490
BEN-DND-a7517465-7
0.490
ADA-UCB-b1b30a00-8
0.490
RAL-THA-04c5403f-1
0.489
EDJ-MED-ba7e64f2-1
0.489
BEN-DND-c852c98b-4
0.489
JAG-UCB-c61058a9-2
0.489
EDJ-MED-51d3200d-4
0.489
RAL-THA-3d7a794f-2
0.489
JAG-UCB-c61058a9-11
0.489
JOH-UNI-1b27fa5e-6
0.489
JAG-UCB-119787ef-1
0.489