Molecule Details
| Molecular Properties | |
| SMILES: | O=C(Cc1cccc(Cl)c1)Nc1n[nH]c2ccc(F)cc12 |
| MW: | 303.06 |
| Fraction sp3: | 0.07 |
| HBA: | 2 |
| HBD: | 2 |
| Rotatable Bonds: | 3 |
| TPSA: | 57.78 |
| cLogP: | 3.54 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Activity Data | |
| IC50 (µM) - Fluorescence: | 99.5 |
| IC50 (µM) - RapidFire: | 88.5840142651519 |
| Order Status | |
| Ordered: | 2020-09-29 |
| Synthesis Location: | enamine |
| Shipped: | 2020-10-28 |
JAG-UCB-52b62a6f-1
EDJ-MED-c8e7a002-11
0.643
NAU-LAT-a5c7d7cb-10
0.643
EDJ-MED-c8e7a002-16
0.616
EDJ-MED-c8e7a002-15
0.526
EDJ-MED-c8e7a002-10
0.494
MAT-POS-199e2e7c-2
0.475
JOH-UNI-6fede743-5
0.470
JIN-POS-6dc588a4-11
0.469
EDJ-MED-c8e7a002-13
0.463
JIN-POS-6dc588a4-16
0.457
JAN-GHE-5a013bed-9
0.444
EDJ-MED-c8e7a002-6
0.440
JIN-POS-6dc588a4-15
0.439
VLA-UCB-00f2c2b3-7
0.438
JIN-POS-6dc588a4-8
0.438
JAN-GHE-5a013bed-11
0.432
JIN-POS-6dc588a4-7
0.432
JAG-UCB-52b62a6f-18
0.430
EDG-MED-0da5ad92-15
0.429
MAT-POS-3cc264b0-1
0.427
EDJ-MED-50fe53e8-1
0.427
EDJ-MED-c8e7a002-14
0.427
RUB-POS-1325a9ea-13
0.427
EDJ-MED-c8e7a002-5
0.425
RUB-POS-1325a9ea-18
0.422
EDG-MED-0da5ad92-21
0.421
ADA-UCB-6c2cb422-1
0.420
PET-UNK-158bee2a-1
0.418
VLA-UNK-4cf5aa07-1
0.418
ALP-POS-cd485364-1
0.417
RUB-POS-1325a9ea-17
0.415
MAT-POS-bb423b95-1
0.415
JIN-POS-6dc588a4-2
0.415
EDG-MED-0da5ad92-2
0.413
MIC-UNK-66895286-1
0.413
JAN-GHE-5a013bed-8
0.413
NAU-LAT-a5c7d7cb-11
0.410
JIN-POS-6dc588a4-13
0.410
JAN-GHE-5a013bed-10
0.408
SAM-UNK-2684b532-12
0.407
JIN-POS-6dc588a4-5
0.407
JIN-POS-6dc588a4-4
0.407
MIC-UNK-668ac5de-1
0.407
PET-UNK-158bee2a-2
0.405
JAN-GHE-5a013bed-6
0.405
MAT-POS-bb423b95-8
0.405
MAT-POS-f7918075-5
0.405
JIN-POS-6dc588a4-12
0.405
EDJ-MED-c5ca5386-1
0.405
JAG-UCB-a3ef7265-15
0.403
SAM-UNK-2684b532-13
0.403
EDG-MED-0da5ad92-13
0.403
VLA-UNK-411a133b-1
0.403
ALP-POS-95b75b4d-8
0.403
ALP-POS-3b848b35-3
0.402
EDJ-MED-c8e7a002-1
0.402
MIC-UNK-7574fcc6-1
0.400
EDJ-MED-c8e7a002-2
0.400
EDJ-MED-6e43a462-8
0.400
JAN-GHE-5a013bed-7
0.400
JOH-UNI-abfda500-4
0.400
NAU-LAT-e1818702-10
0.400
EDJ-MED-50fe53e8-3
0.398
EDJ-MED-c8e7a002-12
0.398
EDG-MED-0da5ad92-12
0.397
ALP-POS-95b75b4d-6
0.397
RUB-POS-1325a9ea-4
0.395
VLA-UNK-4cf5aa07-2
0.395
PET-UNK-158bee2a-4
0.395
ROB-UNI-daaf9793-1
0.393
RUB-POS-1325a9ea-12
0.393
MAT-POS-e1b5ac6b-1
0.393
TRY-UNI-714a760b-6
0.392
MAT-POS-29385cc1-4
0.391
EDJ-MED-c8e7a002-3
0.391
MIC-UNK-d935700b-1
0.390
SAM-UNK-2684b532-11
0.390
VLA-UNK-411a133b-2
0.390
MAT-POS-90fd5f68-6
0.389
PET-UNK-d899bab6-2
0.389
MAT-POS-29385cc1-2
0.389
MIC-UNK-50cce87d-1
0.388
RUB-POS-1325a9ea-5
0.388
RUB-POS-1325a9ea-2
0.388
JAG-UCB-a3ef7265-17
0.385
NAU-LAT-e1818702-7
0.385
PET-UNK-b38839dc-1
0.385
EDJ-MED-49816e9b-2
0.385
EDG-MED-0da5ad92-16
0.385
JAN-GHE-5a013bed-4
0.385
MAT-POS-29385cc1-1
0.385
PET-UNK-8df914d1-4
0.385
PET-UNK-158bee2a-3
0.385
MAT-POS-90fd5f68-27
0.385
RUB-POS-1325a9ea-15
0.384
MIC-UNK-8971c93c-1
0.384
JOH-UNI-6fede743-2
0.384
MAT-POS-f7918075-4
0.384
PET-UNK-7fb4f80a-3
0.383
JOH-UNI-abfda500-5
0.383