Molecule Details
| Molecular Properties | |
| SMILES: | O=C(Cc1cccc(Cl)c1)Nc1cnc(F)c2ccccc12 |
| MW: | 314.06 |
| Fraction sp3: | 0.06 |
| HBA: | 2 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 41.99 |
| cLogP: | 4.21 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Order Status | |
| Ordered: | 2021-03-23 |
| Synthesis Location: | enamine |
| Shipped: | synthesis in progress |
2-halo pyridine
α-Halogen substituted N-heterocycles
Filter94_2_halo_pyridine
2-halopyridine
ADA-UCB-6c2cb422-1
JOH-UNI-6fede743-1
0.657
JIN-POS-6dc588a4-24
0.657
JIN-POS-6dc588a4-23
0.625
ADA-UCB-6c2cb422-1
0.569
MAT-POS-f7918075-6
0.554
JIN-POS-6dc588a4-13
0.554
EDJ-MED-50fe53e8-2
0.554
RUB-POS-1325a9ea-18
0.526
MAT-POS-4211dce8-1
0.520
MAT-POS-bb423b95-9
0.520
JIN-POS-6dc588a4-11
0.519
JOH-UNI-6fede743-3
0.507
JIN-POS-6dc588a4-19
0.507
MAT-POS-bb423b95-6
0.507
RUB-POS-1325a9ea-5
0.506
MIC-UNK-08cd9c58-1
0.500
MAT-POS-f7918075-3
0.500
JIN-POS-6dc588a4-18
0.494
EDG-MED-0da5ad92-16
0.493
PET-UNK-b1ef24dc-3
0.487
JIN-POS-6dc588a4-21
0.487
EDG-MED-0da5ad92-17
0.486
MAT-POS-29385cc1-2
0.482
MAT-POS-bb423b95-1
0.481
JAN-GHE-5a013bed-10
0.479
MAT-POS-c20a539d-5
0.476
PET-UNK-6314f867-2
0.476
RUB-POS-1325a9ea-4
0.475
PET-UNK-7f7e354d-7
0.474
RUB-POS-1325a9ea-13
0.474
JIN-POS-6dc588a4-22
0.474
JIN-POS-6dc588a4-5
0.474
MIC-UNK-d935700b-1
0.474
ABI-SAT-4d06482b-2
0.473
EDG-MED-0da5ad92-21
0.472
ALP-POS-95b75b4d-8
0.472
SAM-UNK-2684b532-13
0.472
PET-UNK-6314f867-3
0.469
MIC-UNK-50cce87d-1
0.468
MAT-POS-f7918075-5
0.468
MAT-POS-bb423b95-8
0.468
JIN-POS-6dc588a4-12
0.468
PET-UNK-b1ef24dc-4
0.468
RUB-POS-1325a9ea-2
0.468
AGN-NEW-c7b24fe3-4
0.467
EDG-MED-0da5ad92-14
0.466
ALP-POS-95b75b4d-6
0.466
PET-UNK-d899bab6-2
0.464
JOH-UNI-6fede743-5
0.463
JOH-UNI-6fede743-2
0.463
RUB-POS-1325a9ea-15
0.463
JIN-POS-6dc588a4-7
0.462
AGN-NEW-c7b24fe3-1
0.461
MAK-UNK-6ca90168-23
0.461
PET-UNK-8df914d1-3
0.459
TRY-UNI-714a760b-6
0.459
PET-UNK-b38839dc-1
0.459
MAT-POS-29385cc1-1
0.459
MAT-POS-c0609ef7-1
0.458
JAN-GHE-5a013bed-6
0.457
JOH-UNI-ee5ed7c8-8
0.457
MAT-POS-c20a539d-6
0.457
MAT-POS-29385cc1-3
0.457
MAT-POS-90fd5f68-40
0.457
JOH-UNI-3fc3434e-8
0.457
MAT-POS-3cc264b0-1
0.456
ROB-UNI-daaf9793-1
0.456
JOH-UNI-6fede743-4
0.456
EDJ-MED-50fe53e8-1
0.456
MAT-POS-e1b5ac6b-1
0.456
SAM-UNK-2684b532-12
0.455
SAM-UNK-2684b532-11
0.455
JIN-POS-6dc588a4-4
0.455
MAT-POS-bb423b95-5
0.455
JIN-POS-6dc588a4-3
0.455
MAT-POS-90fd5f68-24
0.453
PET-UNK-f4e47ebd-2
0.452
PET-UNK-d899bab6-3
0.452
PET-UNK-f4e47ebd-1
0.452
MAT-POS-90fd5f68-38
0.451
MAT-POS-90fd5f68-37
0.451
MAT-POS-c20a539d-2
0.451
MIC-UNK-50cce87d-3
0.450
MAT-POS-bb423b95-2
0.450
RUB-POS-1325a9ea-11
0.450
EDJ-MED-c5ca5386-1
0.450
RUB-POS-1325a9ea-3
0.450
VLA-UCB-00f2c2b3-7
0.449
PET-UNK-c6bcc80b-7
0.448
ANN-UNI-98d2bf15-3
0.447
TRY-UNI-714a760b-3
0.447
AGN-NEW-c7b24fe3-5
0.447
JOH-UNI-abfda500-5
0.447
JOH-UNI-abfda500-4
0.447
PET-UNK-158bee2a-1
0.447
VLA-UNK-4cf5aa07-1
0.447
MAT-POS-90fd5f68-6
0.447
PET-UNK-8df914d1-1
0.446
EDJ-MED-00c1612e-1
0.446
MAT-POS-90fd5f68-1
0.446