Molecular Properties | |
SMILES: | Cc1cc(C(F)(F)F)nc2c1c(N)nn2C(=O)Cc1cccc(Cl)c1 |
MW: | 368.07 |
Fraction sp3: | 0.19 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 2 |
TPSA: | 73.8 |
cLogP: | 3.88 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.5 |
IC50 (µM) - RapidFire: | 99.0 |
Order Status | |
Shipped: | 2020-10-28 |
N-Acyl substituted azoheterocycles
aniline
high halogen content (>3)
MAT-POS-0c8fa4a7-4
0.464
MAT-POS-0c8fa4a7-3
0.446
EDJ-MED-c8e7a002-5
0.444
ALP-POS-902f21bb-1
0.442
ALP-POS-cd485364-1
0.437
ALP-POS-6495d03e-3
0.435
ALP-POS-6495d03e-7
0.430
ALP-POS-6495d03e-6
0.430
MAT-POS-53907a1c-1
0.427
MAT-POS-0c8fa4a7-2
0.427
JAN-GHE-5a013bed-5
0.372
JAN-GHE-5a013bed-1
0.361
EDG-MED-0da5ad92-18
0.360
NAM-UNK-f7c77a48-3
0.358
ALP-POS-cd485364-2
0.358
JAG-UCB-a3ef7265-17
0.357
NAU-LAT-e1818702-7
0.357
SAD-SAT-b55127ae-1
0.345
JOH-UNI-a38a7bdd-4
0.344
EDG-MED-0da5ad92-16
0.341
JAN-GHE-5a013bed-4
0.341
VLA-UNK-411a133b-1
0.341
EDG-MED-0da5ad92-17
0.341
EDJ-MED-c8e7a002-4
0.340
EDJ-MED-49816e9b-3
0.337
EDJ-MED-49816e9b-5
0.337
EDJ-MED-c292668a-1
0.337
MAT-POS-29385cc1-4
0.337
EDJ-MED-c8e7a002-6
0.337
MAT-POS-8feb6e35-2
0.337
PET-UNK-8df914d1-3
0.333
MIC-UNK-50cce87d-3
0.333
RUB-POS-1325a9ea-3
0.333
EDG-MED-0da5ad92-15
0.333
JIN-POS-6dc588a4-4
0.333
SAM-UNK-2684b532-12
0.333
JOH-UNI-a38a7bdd-3
0.330
BAR-COM-ebf5acce-9
0.327
TRY-UNI-714a760b-3
0.326
PET-UNK-8df914d1-4
0.326
NAM-UNK-f7c77a48-4
0.326
PET-UNK-158bee2a-3
0.326
JAG-UCB-a3ef7265-15
0.326
EDJ-MED-49816e9b-2
0.326
MIC-UNK-67d4a29a-3
0.323
MIC-UNK-668ac5de-1
0.323
BEN-DND-1e24cf73-2
0.323
JOH-UNI-50ce7ec3-6
0.323
SAM-UNK-2684b532-14
0.323
EDG-MED-0da5ad92-14
0.322
EDG-MED-0da5ad92-12
0.322
JOH-UNI-50ce7ec3-5
0.320
BAR-COM-ebf5acce-4
0.320
PET-UNK-bbe8d7ff-2
0.319
MAT-POS-7174c657-3
0.319
TRY-UNI-714a760b-6
0.318
DAR-DIA-56cf811e-2
0.316
MAT-POS-bfb445d4-2
0.315
JAN-GHE-f4ca5a00-14
0.315
EDJ-MED-b24713dc-2
0.315
VLA-UNK-411a133b-2
0.314
JOH-UNI-a38a7bdd-7
0.314
JOH-UNI-a38a7bdd-8
0.314
BAR-COM-ebf5acce-6
0.313
JOH-UNI-3fc3434e-13
0.313
JOH-UNI-ee5ed7c8-13
0.313
EDJ-MED-b24713dc-4
0.312
JAN-GHE-83b26c96-15
0.311
EDG-MED-0da5ad92-1
0.311
EDG-MED-0da5ad92-13
0.310
EDG-MED-0da5ad92-21
0.310
EDJ-MED-97c1bf5c-1
0.310
BEN-DND-1e24cf73-3
0.309
NAU-LAT-a5c7d7cb-11
0.309
JIN-POS-6dc588a4-6
0.309
NAU-LAT-e1818702-9
0.309
NAU-LAT-e1818702-8
0.309
NAU-LAT-e1818702-1
0.308
JAN-GHE-f4ca5a00-12
0.308
DAR-DIA-56cf811e-6
0.307
JOH-UNI-3fc3434e-3
0.306
JOH-UNI-ee5ed7c8-3
0.306
BAR-COM-ebf5acce-3
0.306
EDJ-MED-c8e7a002-7
0.305
EDJ-MED-076d6e64-1
0.305
PET-UNK-bbe8d7ff-1
0.305
JAN-GHE-5a013bed-3
0.305
EDJ-MED-c8e7a002-8
0.305
PET-UNK-8df914d1-5
0.304
JAN-GHE-f4ca5a00-16
0.304
JAN-GHE-5a013bed-2
0.304
PET-UNK-f92d7c0c-3
0.303
DAR-DIA-076fb6ea-6
0.303
BAR-COM-ebf5acce-15
0.303
EDJ-MED-c5ca5386-2
0.303
MIC-UNK-66895286-1
0.302
JAN-GHE-5a013bed-11
0.302
EDJ-MED-6e43a462-10
0.302
DAR-DIA-076fb6ea-16
0.302
JAN-GHE-f4ca5a00-17
0.301