Molecular Properties | |
SMILES: | O=C(Nc1[nH]nc2ccc(F)cc12)C1CCOc2ccc(Cl)cc21 |
MW: | 345.07 |
Fraction sp3: | 0.18 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 2 |
TPSA: | 67.01 |
cLogP: | 3.86 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-09-29 |
Synthesis Location: | enamine |
Shipped: | 2020-11-04 |
VLA-UCB-1dbca3b4-15
JAG-UCB-52b62a6f-9
0.744
JAG-UCB-52b62a6f-8
0.718
JAG-UCB-52b62a6f-6
0.679
JAG-UCB-52b62a6f-12
0.640
JAG-UCB-52b62a6f-18
0.604
JAG-UCB-52b62a6f-5
0.582
EDG-MED-5d232de5-1
0.571
ALP-POS-ce760d3f-7
0.571
ALP-POS-696356e4-1
0.571
EDG-MED-5d232de5-2
0.571
JOH-SUS-a69c159d-7
0.570
JOH-SUS-a69c159d-5
0.570
PET-UNK-03fd2068-1
0.559
JAG-UCB-52b62a6f-7
0.548
NAU-LAT-8502cac5-12
0.511
JOH-SUS-a69c159d-6
0.511
LON-WEI-0a73fcb8-3
0.510
VLA-UCB-53bdeed6-2
0.505
NAU-LAT-8502cac5-11
0.505
ROB-UNI-569bc02e-3
0.505
NAU-LAT-8502cac5-13
0.505
JOH-SUS-a69c159d-2
0.505
JAG-UCB-52b62a6f-17
0.505
JAG-UCB-52b62a6f-19
0.505
NAU-LAT-8502cac5-10
0.500
RAL-THA-b74298ba-1
0.500
RAL-THA-3d7a794f-4
0.500
BEN-DND-c852c98b-2
0.495
PET-UNK-6314f867-1
0.495
JAG-UCB-52b62a6f-16
0.495
MIC-UNK-7574fcc6-2
0.495
VLA-UCB-1dbca3b4-15
0.495
MAT-POS-f7918075-1
0.495
MAT-POS-b3e365b9-2
0.495
PET-UNK-b1ef24dc-7
0.495
MAT-POS-b3e365b9-1
0.495
PET-UNK-158bee2a-5
0.495
VLA-UNK-0ffe3317-7
0.495
VLA-UCB-53bdeed6-3
0.495
JOH-UNI-d0d90dc1-3
0.495
JAG-UCB-c61058a9-6
0.495
JOH-UNI-1b27fa5e-4
0.490
MIC-UNK-deda7a44-7
0.490
ROB-UNI-569bc02e-5
0.490
RAL-THA-3d7a794f-2
0.489
JOH-UNI-1b27fa5e-6
0.489
NAU-LAT-8502cac5-16
0.489
DAR-DIA-6a508060-6
0.489
JAN-GHE-f4ca5a00-13
0.489
BRU-CON-c4e3408a-1
0.489
JAG-UCB-c61058a9-21
0.489
JAG-UCB-c61058a9-41
0.489
JAG-UCB-119787ef-1
0.489
JAG-UCB-a3ef7265-20
0.489
RAL-THA-b74298ba-3
0.489
MAT-POS-968e8d9c-1
0.489
NAU-LAT-8502cac5-15
0.489
EDG-MED-fe7487f8-9
0.489
MAT-POS-b3e365b9-3
0.489
MAT-POS-b3e365b9-4
0.489
PET-UNK-158bee2a-7
0.489
MIC-UNK-42806bd5-4
0.489
ALP-POS-82da25a3-1
0.485
JAG-UCB-52b62a6f-15
0.485
MAT-POS-14f31916-5
0.485
ADA-UCB-b1b30a00-6
0.485
VLA-UNK-0ffe3317-1
0.484
MAT-POS-a2421bb6-4
0.484
MIC-UNK-deda7a44-6
0.484
RAL-THA-3d7a794f-1
0.484
JAG-UCB-c61058a9-9
0.484
TAT-ENA-0e28ea53-1
0.484
PET-UNK-3e029fdc-1
0.484
MAT-POS-b5c94171-1
0.484
JOH-UNI-1b27fa5e-7
0.484
JAG-UCB-c61058a9-22
0.484
NAU-LAT-b7d8c353-4
0.484
BEN-DND-b89db3f2-2
0.484
MAK-UNK-8be7dca9-5
0.480
BEN-DND-c852c98b-7
0.480
JAG-UCB-52b62a6f-14
0.480
ROB-UNI-569bc02e-4
0.480
JOH-UNI-1b27fa5e-1
0.480
VLA-UCB-05e51b3f-19
0.480
VLA-UCB-50c39ae8-12
0.480
JAG-UCB-52b62a6f-13
0.480
MAK-UNK-8be7dca9-9
0.480
ALF-EVA-5b152d2f-2
0.480
RAL-THA-b74298ba-4
0.479
ERI-UCB-a38d41be-1
0.479
ALP-POS-ce760d3f-2
0.479
PET-UNK-b1ef24dc-8
0.479
BEN-DND-4f474d93-1
0.479
BEN-DND-4f474d93-3
0.479
ERI-UCB-9c7ec71b-2
0.479
EDJ-MED-e9694d2b-1
0.479
ERI-UCB-9c7ec71b-4
0.479
LON-WEI-0a73fcb8-6
0.479
EDG-MED-fe7487f8-8
0.479
JAG-UCB-c61058a9-44
0.479