Molecule Details
| Molecular Properties | |
| SMILES: | O=C(Cc1cccc(Cl)c1)Nc1noc2cnccc12 |
| MW: | 287.05 |
| Fraction sp3: | 0.07 |
| HBA: | 4 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 68.02 |
| cLogP: | 3.06 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Order Status | |
| Ordered: | 2021-03-23 |
| Synthesis Location: | enamine |
| Shipped: | synthesis in progress |
ADA-UCB-6c2cb422-1
JIN-POS-6dc588a4-8
0.643
EDJ-MED-c8e7a002-1
0.605
JIN-POS-6dc588a4-2
0.568
JIN-POS-6dc588a4-15
0.513
EDJ-MED-c8e7a002-16
0.513
PET-UNK-b1ef24dc-3
0.494
EDG-MED-0da5ad92-2
0.493
MAT-POS-bb423b95-1
0.487
JAN-GHE-5a013bed-9
0.486
SAM-UNK-2684b532-13
0.479
ALP-POS-95b75b4d-8
0.479
ALP-POS-95b75b4d-6
0.473
JAN-GHE-5a013bed-8
0.472
TRY-UNI-714a760b-6
0.467
EDG-MED-0da5ad92-15
0.467
JIN-POS-6dc588a4-3
0.462
SAM-UNK-2684b532-11
0.462
EDJ-MED-c8e7a002-9
0.457
EDJ-MED-c8e7a002-11
0.456
NAU-LAT-a5c7d7cb-10
0.456
ANN-UNI-98d2bf15-3
0.455
JOH-UNI-abfda500-5
0.455
JOH-UNI-abfda500-4
0.455
MAK-UNK-6ca90168-23
0.449
PET-UNK-7f7e354d-7
0.444
JIN-POS-6dc588a4-6
0.444
JIN-POS-6dc588a4-4
0.443
MAT-POS-bb423b95-5
0.443
SAM-UNK-2684b532-12
0.443
RUB-POS-1325a9ea-19
0.443
PET-UNK-8df914d1-4
0.440
MAT-POS-f7918075-5
0.439
MAT-POS-199e2e7c-2
0.439
ALP-POS-95b75b4d-7
0.438
EDG-MED-0da5ad92-12
0.434
MAT-POS-bb423b95-4
0.432
ALP-POS-95b75b4d-5
0.432
VLA-UNK-4cf5aa07-2
0.430
PET-UNK-b1ef24dc-1
0.427
ALP-POS-0c2c77e1-1
0.427
MAT-POS-bb423b95-3
0.427
JIN-POS-6dc588a4-22
0.427
MAT-POS-3cc264b0-1
0.427
EDJ-MED-50fe53e8-1
0.427
JAN-GHE-5a013bed-10
0.427
JAN-GHE-5a013bed-6
0.425
PET-UNK-158bee2a-2
0.425
ABI-SAT-4d06482b-2
0.423
MAT-POS-199e2e7c-1
0.422
EDJ-MED-6e43a462-5
0.422
JAN-GHE-5a013bed-7
0.419
NAU-LAT-e1818702-10
0.419
TRY-UNI-714a760b-3
0.418
EDJ-MED-c8e7a002-15
0.417
JIN-POS-6dc588a4-7
0.415
MAT-POS-bb423b95-9
0.415
JAN-GHE-5a013bed-11
0.413
MIC-UNK-66895286-1
0.413
PET-UNK-8df914d1-3
0.410
NAU-LAT-a5c7d7cb-11
0.410
EDG-MED-0da5ad92-18
0.405
EDJ-MED-6e43a462-6
0.405
PET-UNK-158bee2a-3
0.403
EDG-MED-0da5ad92-13
0.403
EDG-MED-0da5ad92-16
0.403
EDJ-MED-49816e9b-2
0.403
EDG-MED-0da5ad92-21
0.403
ADA-UCB-6c2cb422-1
0.402
VLA-UCB-00f2c2b3-7
0.402
RUB-POS-1325a9ea-8
0.400
EDG-MED-0da5ad92-17
0.400
MAT-POS-f7918075-3
0.400
JIN-POS-6dc588a4-23
0.400
MIC-UNK-08cd9c58-1
0.400
EDJ-MED-a364e151-1
0.400
JIN-POS-6dc588a4-20
0.398
EDJ-MED-976da9a6-2
0.398
MAT-POS-14ad9fe9-1
0.398
MAT-POS-90fd5f68-22
0.398
EDJ-MED-50fe53e8-3
0.398
EDJ-MED-49816e9b-3
0.397
EDG-MED-0da5ad92-14
0.397
AGN-NEW-c7b24fe3-1
0.395
PET-UNK-158bee2a-4
0.395
JIN-POS-6dc588a4-13
0.393
PET-UNK-e274cad4-6
0.393
EDJ-MED-a364e151-3
0.393
EDJ-MED-6e43a462-7
0.393
RUB-POS-1325a9ea-13
0.393
EDG-MED-0da5ad92-6
0.392
EDJ-MED-c8e7a002-6
0.391
PET-UNK-8df914d1-5
0.390
VLA-UNK-411a133b-2
0.390
PET-UNK-b1ef24dc-4
0.388
JIN-POS-6dc588a4-24
0.388
EDJ-MED-076d6e64-1
0.388
JIN-POS-6dc588a4-10
0.388
JIN-POS-6dc588a4-14
0.388
RUB-POS-1325a9ea-5
0.388
JIN-POS-6dc588a4-12
0.388