Molecular Properties | |
SMILES: | O=C(Cc1cccc(Cl)c1)Nc1c(Cl)ncn2c(O)nnc12 |
MW: | 337.01 |
Fraction sp3: | 0.08 |
HBA: | 6 |
HBD: | 2 |
Rotatable Bonds: | 3 |
TPSA: | 92.41 |
cLogP: | 2.32 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-09-29 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
α-Halogen substituted N-heterocycles
4-halopyridine
2-halopyridine
halo-pyridine,_-diazoles_and_-triazoles
JAG-UCB-52b62a6f-1
EDJ-MED-7bb79bc5-1
0.689
EDJ-MED-c8e7a002-7
0.573
EDJ-MED-c8e7a002-8
0.573
EDJ-MED-97c1bf5c-1
0.524
EDJ-MED-49816e9b-2
0.459
EDJ-MED-97c1bf5c-2
0.459
EDJ-MED-c8e7a002-4
0.446
EDG-MED-0da5ad92-18
0.442
JAG-UCB-a3ef7265-17
0.440
JAG-UCB-a3ef7265-15
0.440
NAU-LAT-e1818702-7
0.440
JAN-GHE-5a013bed-7
0.438
NAU-LAT-e1818702-10
0.438
JAG-UCB-52b62a6f-1
0.435
JOH-UNI-6fede743-2
0.434
JAN-GHE-5a013bed-11
0.432
JOH-UNI-6fede743-4
0.427
NAU-LAT-e1818702-8
0.427
NAU-LAT-e1818702-9
0.427
PET-UNK-8df914d1-4
0.421
ALP-POS-95b75b4d-8
0.421
EDG-MED-0da5ad92-13
0.421
SAM-UNK-2684b532-13
0.421
PET-UNK-e44ffd04-1
0.420
NAU-LAT-a5c7d7cb-12
0.420
JOH-UNI-6fede743-5
0.419
ALP-POS-95b75b4d-6
0.416
EDG-MED-0da5ad92-14
0.416
EDJ-MED-49816e9b-5
0.416
PET-UNK-8df914d1-2
0.415
EDJ-MED-50fe53e8-3
0.415
JAN-GHE-5a013bed-8
0.413
AGN-NEW-c7b24fe3-1
0.412
JAN-GHE-f4ca5a00-12
0.412
NAU-LAT-e1818702-1
0.412
EDG-MED-0da5ad92-15
0.410
EDJ-MED-50fe53e8-4
0.410
JAN-GHE-5a013bed-10
0.408
JAN-GHE-5a013bed-6
0.405
JAN-GHE-5a013bed-9
0.405
JAN-GHE-5a013bed-5
0.403
AGN-NEW-c7b24fe3-4
0.400
AGN-NEW-c7b24fe3-5
0.400
EDJ-MED-49816e9b-3
0.397
JOH-UNI-3fc3434e-8
0.395
JOH-UNI-ee5ed7c8-8
0.395
EDG-MED-0da5ad92-2
0.395
MIC-UNK-66895286-1
0.395
SAM-UNK-2684b532-12
0.390
SAM-UNK-2684b532-11
0.390
PET-UNK-8df914d1-5
0.390
JAN-GHE-5a013bed-1
0.390
JOH-UNI-6fede743-1
0.388
ABI-SAT-4d06482b-2
0.388
EDG-MED-0da5ad92-21
0.385
EDG-MED-0da5ad92-16
0.385
EDG-MED-0da5ad92-17
0.383
JOH-UNI-abfda500-5
0.383
ANN-UNI-98d2bf15-3
0.383
MAT-POS-14ad9fe9-1
0.382
EDG-MED-0da5ad92-12
0.380
JOH-UNI-ee5ed7c8-11
0.378
JOH-UNI-3fc3434e-11
0.378
NAU-LAT-a5c7d7cb-11
0.376
TRY-UNI-714a760b-6
0.375
EDJ-MED-c8e7a002-6
0.375
PET-UNK-8df914d1-3
0.375
EDJ-MED-c8e7a002-3
0.375
MAT-POS-bb423b95-8
0.372
EDJ-MED-c8e7a002-1
0.371
ALP-POS-3b848b35-3
0.369
EDJ-MED-c8e7a002-11
0.369
NAU-LAT-a5c7d7cb-10
0.369
VLA-UCB-00f2c2b3-7
0.369
EDJ-MED-c8e7a002-2
0.368
JAN-GHE-5a013bed-4
0.367
JOH-UNI-abfda500-4
0.366
TRY-UNI-714a760b-3
0.366
EDJ-MED-c8e7a002-12
0.365
MAT-POS-f7918075-7
0.364
MAK-UNK-6ca90168-23
0.361
EDJ-MED-c8e7a002-14
0.360
EDJ-MED-50fe53e8-2
0.360
EDJ-MED-c8e7a002-13
0.360
MAT-POS-3cc264b0-1
0.360
MAT-POS-f7918075-6
0.360
MAT-POS-bb423b95-3
0.360
ALP-POS-0c2c77e1-1
0.360
EDJ-MED-50fe53e8-1
0.360
JAN-GHE-f4ca5a00-16
0.357
MAT-POS-bb423b95-5
0.357
MIC-UNK-d935700b-1
0.357
JAN-GHE-5a013bed-2
0.357
EDJ-MED-c8e7a002-16
0.356
MAT-POS-199e2e7c-2
0.356
EDJ-MED-c8e7a002-9
0.356
EDJ-MED-c8e7a002-10
0.356
MIC-UNK-d935700b-2
0.356
MAT-POS-199e2e7c-1
0.356
MAT-POS-bb423b95-2
0.356