Molecule Details
| Molecular Properties | |
| SMILES: | O=C(Cc1cccc(Cl)c1)Nc1noc2ncccc12 |
| MW: | 287.05 |
| Fraction sp3: | 0.07 |
| HBA: | 4 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 68.02 |
| cLogP: | 3.06 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Activity Data | |
| IC50 (µM) - Fluorescence: | 99.5 |
| Order Status | |
| Ordered: | 2021-03-23 |
| Synthesis Location: | enamine |
| Shipped: | 2021-05-06 |
ADA-UCB-6c2cb422-1
JIN-POS-6dc588a4-8
0.569
JIN-POS-6dc588a4-16
0.568
JIN-POS-6dc588a4-15
0.547
EDJ-MED-c8e7a002-1
0.500
EDG-MED-0da5ad92-2
0.486
MAT-POS-f7918075-3
0.481
MIC-UNK-08cd9c58-1
0.481
EDG-MED-0da5ad92-15
0.479
EDG-MED-0da5ad92-14
0.466
JAN-GHE-5a013bed-8
0.465
JIN-POS-6dc588a4-7
0.462
VLA-UNK-4cf5aa07-2
0.461
AGN-NEW-c7b24fe3-1
0.461
PET-UNK-158bee2a-2
0.457
JAN-GHE-5a013bed-9
0.457
MAT-POS-199e2e7c-2
0.450
EDJ-MED-c8e7a002-16
0.450
NAU-LAT-a5c7d7cb-10
0.449
EDJ-MED-c8e7a002-11
0.449
AGN-NEW-c7b24fe3-4
0.447
AGN-NEW-c7b24fe3-5
0.447
JAN-GHE-5a013bed-11
0.444
EDJ-MED-50fe53e8-1
0.438
MAT-POS-3cc264b0-1
0.438
EDJ-MED-c8e7a002-14
0.438
NAU-LAT-a5c7d7cb-11
0.438
ALP-POS-95b75b4d-8
0.432
EDG-MED-0da5ad92-13
0.432
EDJ-MED-49816e9b-2
0.432
SAM-UNK-2684b532-13
0.432
MAT-POS-bb423b95-2
0.432
PET-UNK-b1ef24dc-3
0.432
JOH-UNI-abfda500-4
0.429
EDJ-MED-c8e7a002-15
0.427
EDJ-MED-49816e9b-3
0.427
EDG-MED-0da5ad92-12
0.427
ALP-POS-95b75b4d-6
0.427
MAT-POS-bb423b95-9
0.425
EDJ-MED-50fe53e8-3
0.425
PET-UNK-158bee2a-4
0.425
MAT-POS-14ad9fe9-1
0.424
PET-UNK-8df914d1-3
0.421
TRY-UNI-714a760b-6
0.421
JAN-GHE-5a013bed-10
0.419
SAM-UNK-2684b532-12
0.418
JIN-POS-6dc588a4-4
0.418
RUB-POS-1325a9ea-19
0.418
JAN-GHE-5a013bed-6
0.417
ABI-SAT-4d06482b-2
0.416
EDG-MED-0da5ad92-18
0.416
EDJ-MED-c8e7a002-9
0.415
EDJ-MED-6e43a462-6
0.415
EDJ-MED-6e43a462-5
0.415
JOH-UNI-6fede743-1
0.415
VLA-UNK-411a133b-1
0.413
JAG-UCB-a3ef7265-15
0.413
PET-UNK-8df914d1-4
0.413
JIN-POS-6dc588a4-19
0.412
JOH-UNI-6fede743-3
0.412
MAT-POS-bb423b95-6
0.412
ADA-UCB-6c2cb422-1
0.412
JAN-GHE-5a013bed-7
0.411
NAU-LAT-e1818702-10
0.411
ANN-UNI-98d2bf15-3
0.410
JOH-UNI-abfda500-5
0.410
PET-UNK-158bee2a-1
0.410
VLA-UNK-4cf5aa07-1
0.410
JIN-POS-6dc588a4-23
0.410
EDJ-MED-49816e9b-5
0.408
MAT-POS-bb423b95-1
0.407
ALP-POS-95b75b4d-5
0.407
MAT-POS-bb423b95-4
0.407
RUB-POS-1325a9ea-17
0.407
MIC-UNK-66895286-1
0.405
MAK-UNK-6ca90168-23
0.405
MAT-POS-f7918075-7
0.405
RUB-POS-1325a9ea-1
0.405
EDJ-MED-6e43a462-7
0.402
EDJ-MED-a364e151-3
0.402
PET-UNK-7f7e354d-7
0.402
JOH-UNI-6fede743-4
0.402
JIN-POS-6dc588a4-17
0.402
JIN-POS-6dc588a4-13
0.402
PET-UNK-b1ef24dc-1
0.402
PET-UNK-8df914d1-5
0.400
MAT-POS-bb423b95-5
0.400
SAM-UNK-2684b532-11
0.400
JIN-POS-6dc588a4-3
0.400
EDJ-MED-c8e7a002-6
0.400
VLA-UNK-411a133b-2
0.400
EDJ-MED-6e43a462-4
0.398
TRY-UNI-1fd04853-5
0.398
RUB-POS-1325a9ea-18
0.398
MAT-POS-199e2e7c-1
0.398
RUB-POS-1325a9ea-5
0.398
JIN-POS-6dc588a4-10
0.398
JIN-POS-6dc588a4-24
0.398
RUB-POS-1325a9ea-11
0.398
MAT-POS-f7918075-5
0.398
JIN-POS-6dc588a4-21
0.398