Molecule Details
| Molecular Properties | |
| SMILES: | O=C(Cc1cccc(Cl)c1)Nc1cc2nccn2cn1 |
| MW: | 286.06 |
| Fraction sp3: | 0.07 |
| HBA: | 4 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 59.29 |
| cLogP: | 2.56 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Order Status | |
| Ordered: | 2021-03-23 |
| Synthesis Location: | enamine |
| Shipped: | synthesis in progress |
ADA-UCB-6c2cb422-1
RUB-POS-1325a9ea-8
0.494
JAN-GHE-5a013bed-8
0.479
EDJ-MED-50fe53e8-3
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JIN-POS-6dc588a4-15
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EDJ-MED-6e43a462-5
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EDG-MED-0da5ad92-14
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EDG-MED-0da5ad92-15
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EDJ-MED-6e43a462-7
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PET-UNK-158bee2a-2
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EDJ-MED-6e43a462-4
0.427
EDJ-MED-6e43a462-6
0.427
EDJ-MED-c8e7a002-7
0.427
PET-UNK-8df914d1-4
0.427
JAG-UCB-a3ef7265-17
0.427
NAU-LAT-e1818702-7
0.427
EDJ-MED-49816e9b-2
0.427
VLA-UNK-411a133b-1
0.427
EDJ-MED-b24713dc-2
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NAU-LAT-a5c7d7cb-12
0.425
PET-UNK-e44ffd04-1
0.425
BEN-DND-02317c5c-8
0.425
ALP-POS-95b75b4d-6
0.421
EDJ-MED-49816e9b-3
0.421
PET-UNK-8df914d1-2
0.420
PET-UNK-158bee2a-4
0.419
JAN-GHE-5a013bed-11
0.419
EDG-MED-0da5ad92-2
0.419
AGN-NEW-c7b24fe3-1
0.418
EDJ-MED-c8e7a002-4
0.417
BEN-DND-02317c5c-9
0.415
EDJ-MED-50fe53e8-4
0.415
VLA-UNK-411a133b-2
0.413
JAN-GHE-5a013bed-6
0.411
JAN-GHE-5a013bed-9
0.411
ABI-SAT-4d06482b-2
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EDG-MED-0da5ad92-18
0.410
JAN-GHE-5a013bed-5
0.408
EDG-MED-0da5ad92-16
0.408
SAM-UNK-2684b532-13
0.408
JAG-UCB-a3ef7265-15
0.408
ALP-POS-95b75b4d-8
0.408
EDG-MED-0da5ad92-13
0.408
PET-UNK-158bee2a-3
0.408
NAU-LAT-e1818702-10
0.405
JAN-GHE-5a013bed-7
0.405
ANN-UNI-98d2bf15-3
0.405
AGN-NEW-c7b24fe3-4
0.405
JOH-UNI-abfda500-5
0.405
AGN-NEW-c7b24fe3-5
0.405
MAT-POS-f7918075-3
0.405
MIC-UNK-08cd9c58-1
0.405
EDJ-MED-b24713dc-1
0.405
EDJ-MED-49816e9b-5
0.403
EDG-MED-0da5ad92-12
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EDJ-MED-6e43a462-9
0.402
JIN-POS-6dc588a4-9
0.402
JIN-POS-6dc588a4-2
0.402
MIC-UNK-66895286-1
0.400
JAN-GHE-f4ca5a00-12
0.400
NAU-LAT-e1818702-1
0.400
TRY-UNI-714a760b-6
0.397
PET-UNK-8df914d1-3
0.397
EDJ-MED-c8e7a002-6
0.395
PET-UNK-8df914d1-5
0.395
JAN-GHE-5a013bed-2
0.395
JAN-GHE-5a013bed-10
0.395
EDJ-MED-076d6e64-1
0.393
JIN-POS-6dc588a4-10
0.393
EDJ-MED-c8e7a002-8
0.393
EDJ-MED-c8e7a002-17
0.393
MAT-POS-199e2e7c-2
0.393
EDJ-MED-6e43a462-2
0.391
JIN-POS-6dc588a4-8
0.390
ALP-POS-95b75b4d-7
0.390
EDJ-MED-c8e7a002-11
0.390
NAU-LAT-a5c7d7cb-10
0.390
EDG-MED-0da5ad92-21
0.390
EDJ-MED-6e43a462-3
0.388
EDJ-MED-b24713dc-3
0.388
EDJ-MED-6e43a462-8
0.388
EDJ-MED-6e43a462-10
0.388
EDJ-MED-c8e7a002-15
0.388
RUB-POS-1325a9ea-22
0.388
EDG-MED-0da5ad92-17
0.388
JOH-UNI-abfda500-4
0.388
VLA-UNK-4cf5aa07-1
0.388
PET-UNK-158bee2a-1
0.388
EDJ-MED-6e43a462-1
0.386
BEN-DND-1e24cf73-1
0.386
MAT-POS-bb423b95-1
0.386
EDJ-MED-b24713dc-4
0.384
EDJ-MED-6e43a462-12
0.384
MAK-UNK-6ca90168-23
0.383
VLA-UNK-4cf5aa07-2
0.383
NAU-LAT-e1818702-9
0.381
PET-UNK-e274cad4-6
0.381
BEN-DND-1e24cf73-3
0.381
MAT-POS-bb423b95-3
0.381
ALP-POS-0c2c77e1-1
0.381
NAU-LAT-a5c7d7cb-11
0.381