Molecule Details
| Molecular Properties | |
| SMILES: | Nc1nn(C(=O)Cc2cccc(Cl)c2)c2ccccc12 |
| MW: | 285.07 |
| Fraction sp3: | 0.07 |
| HBA: | 4 |
| HBD: | 1 |
| Rotatable Bonds: | 2 |
| TPSA: | 60.91 |
| cLogP: | 3.15 |
| 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
ALP-POS-902f21bb-1
0.652
ALP-POS-cd485364-1
0.643
MAT-POS-53907a1c-1
0.625
MAT-POS-0c8fa4a7-2
0.625
ALP-POS-6495d03e-7
0.592
MAT-POS-0c8fa4a7-4
0.569
NAU-LAT-a5c7d7cb-11
0.449
ALP-POS-79636100-3
0.446
JAN-GHE-5a013bed-2
0.410
NAM-UNK-f7c77a48-3
0.408
JAN-GHE-5a013bed-5
0.406
SAD-SAT-b55127ae-1
0.392
VLA-UNK-411a133b-1
0.387
NAM-UNK-f7c77a48-4
0.387
EDJ-MED-50fe53e8-3
0.383
EDJ-MED-c292668a-1
0.380
JAN-GHE-5a013bed-3
0.373
EDG-MED-0da5ad92-18
0.372
ALP-POS-6495d03e-3
0.371
NAU-LAT-a5c7d7cb-10
0.370
MAT-POS-bfb445d4-2
0.370
EDJ-MED-c8e7a002-11
0.370
JIN-POS-6dc588a4-8
0.370
JIN-POS-6dc588a4-23
0.369
PET-UNK-8df914d1-4
0.368
PET-UNK-158bee2a-1
0.367
VLA-UNK-4cf5aa07-1
0.367
MAT-POS-bb423b95-9
0.366
JIN-POS-6dc588a4-7
0.366
JIN-POS-6dc588a4-9
0.366
VLA-UNK-4cf5aa07-2
0.362
EDJ-MED-50fe53e8-1
0.361
MAT-POS-3cc264b0-1
0.361
JOH-UNI-6fede743-4
0.361
JIN-POS-6dc588a4-24
0.357
JOH-UNI-6fede743-3
0.354
ADA-UCB-6c2cb422-1
0.354
MAT-POS-bb423b95-6
0.354
JIN-POS-6dc588a4-19
0.354
MAT-POS-3b92565d-13
0.353
JOH-UNI-6fede743-2
0.353
ALP-POS-cd485364-2
0.352
NAU-LAT-e1818702-7
0.351
JAG-UCB-a3ef7265-17
0.351
JAN-GHE-5a013bed-4
0.351
TRY-UNI-714a760b-3
0.350
DAR-DIA-6a49afbe-1
0.349
VLA-UNK-dc1d9354-1
0.349
ROB-CAM-6936528f-1
0.349
VLA-UCB-1dbca3b4-2
0.349
MAT-POS-4211dce8-1
0.349
JIN-POS-6dc588a4-2
0.349
RUB-POS-1325a9ea-17
0.349
JOH-UNI-3fc3434e-8
0.349
JOH-UNI-ee5ed7c8-8
0.349
EDG-MED-0da5ad92-12
0.346
MIC-UNK-13557a72-1
0.346
EDJ-MED-49816e9b-5
0.346
EDJ-MED-49816e9b-3
0.346
MAT-POS-f7918075-6
0.345
EDJ-MED-50fe53e8-2
0.345
SAM-UNK-2684b532-14
0.345
JAN-GHE-5a013bed-11
0.342
EDG-MED-0da5ad92-15
0.342
JIN-POS-6dc588a4-5
0.341
MAT-POS-7174c657-3
0.341
MAT-POS-7174c657-2
0.341
JOH-UNI-6fede743-1
0.341
JIN-POS-6dc588a4-21
0.341
RUB-POS-1325a9ea-18
0.341
VLA-UNK-411a133b-2
0.338
JAN-GHE-5a013bed-1
0.338
JAN-GHE-f4ca5a00-17
0.337
EDJ-MED-6e43a462-10
0.337
MAT-POS-bb423b95-7
0.337
JOH-UNI-50ce7ec3-1
0.337
JOH-UNI-abfda500-5
0.333
EDJ-MED-49816e9b-2
0.333
EDJ-MED-97c1bf5c-2
0.333
JAN-GHE-5a013bed-9
0.333
JAG-UCB-a3ef7265-15
0.333
BEN-DND-1e24cf73-1
0.333
ANN-UNI-98d2bf15-3
0.333
EDG-MED-0da5ad92-17
0.333
SAM-UNK-2684b532-13
0.333
ALP-POS-95b75b4d-8
0.333
JOH-UNI-50ce7ec3-3
0.333
JAN-GHE-5a013bed-6
0.333
PET-UNK-158bee2a-3
0.333
PET-UNK-158bee2a-2
0.333
VLA-UCB-05e51b3f-16
0.330
DAR-DIA-076fb6ea-1
0.330
VLA-UCB-05e51b3f-17
0.330
PET-UNK-6c2be958-1
0.330
VLA-UCB-05e51b3f-15
0.330
PET-UNK-12d8d43f-1
0.330
EDJ-MED-c8e7a002-6
0.330
BEN-DND-1e24cf73-5
0.330
ROB-UNI-daaf9793-1
0.329
JIN-POS-6dc588a4-13
0.329