Molecule Details
| Molecular Properties | |
| SMILES: | Cc1cccc2ncc(NC(=O)Cc3cccc(Cl)c3)n12 |
| MW: | 299.08 |
| Fraction sp3: | 0.12 |
| HBA: | 3 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 46.4 |
| cLogP: | 3.48 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Activity Data | |
| IC50 (µM) - Fluorescence: | 5.53975766212724 |
| Order Status | |
| Ordered: | 2021-06-25 |
| Synthesis Location: | enamine |
| Shipped: | 2021-07-21 |
EDJ-MED-6e43a462-3
0.681
PET-UNK-8df914d1-2
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EDJ-MED-b24713dc-1
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EDJ-MED-b24713dc-3
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EDJ-MED-6e43a462-7
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EDJ-MED-6e43a462-9
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EDJ-MED-6e43a462-2
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PET-UNK-8df914d1-4
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BEN-DND-1e24cf73-3
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EDJ-MED-6e43a462-12
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EDJ-MED-6e43a462-1
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EDJ-MED-6e43a462-5
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EDJ-MED-6e43a462-6
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EDJ-MED-6e43a462-10
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EDJ-MED-6e43a462-8
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EDJ-MED-6e43a462-13
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EDJ-MED-b24713dc-4
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BEN-DND-1e24cf73-7
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EDJ-MED-6e43a462-4
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EDJ-MED-6e43a462-11
0.481
EDG-MED-0da5ad92-13
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EDJ-MED-49816e9b-3
0.472
JAN-GHE-5a013bed-8
0.471
VLA-UNK-411a133b-2
0.465
JAN-GHE-5a013bed-6
0.464
PET-UNK-8df914d1-5
0.461
ABI-SAT-4d06482b-2
0.459
EDG-MED-0da5ad92-16
0.458
EDG-MED-0da5ad92-21
0.458
JAG-UCB-a3ef7265-15
0.458
EDJ-MED-49816e9b-2
0.458
PET-UNK-158bee2a-3
0.458
BEN-DND-1e24cf73-2
0.457
EDG-MED-0da5ad92-17
0.453
EDG-MED-0da5ad92-14
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EDG-MED-0da5ad92-12
0.452
EDJ-MED-49816e9b-5
0.452
BEN-DND-1e24cf73-1
0.449
PET-UNK-8df914d1-3
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TRY-UNI-714a760b-6
0.446
JAN-GHE-5a013bed-9
0.443
BEN-DND-1e24cf73-6
0.440
EDG-MED-0da5ad92-18
0.440
NAU-LAT-e1818702-7
0.438
SAM-UNK-2684b532-13
0.438
ALP-POS-95b75b4d-8
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VLA-UNK-411a133b-1
0.438
JAG-UCB-a3ef7265-17
0.438
MAT-POS-51833a24-3
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TRY-UNI-714a760b-3
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EDG-MED-0da5ad92-2
0.431
MIC-UNK-66895286-1
0.431
PET-UNK-158bee2a-4
0.431
EDG-MED-0da5ad92-15
0.427
JIN-POS-6dc588a4-17
0.425
JAN-GHE-5a013bed-10
0.425
RUB-POS-1325a9ea-19
0.423
MIC-UNK-d935700b-1
0.423
MAT-POS-bb423b95-5
0.423
PET-UNK-158bee2a-2
0.423
BEN-DND-1e24cf73-5
0.422
MIC-UNK-f2576da4-1
0.422
BEN-DND-1e24cf73-4
0.419
BEN-DND-02317c5c-8
0.418
PET-UNK-e44ffd04-1
0.418
NAU-LAT-a5c7d7cb-12
0.418
JAN-GHE-5a013bed-7
0.417
NAU-LAT-e1818702-10
0.417
ALP-POS-95b75b4d-6
0.413
RUB-POS-1325a9ea-17
0.412
JIN-POS-6dc588a4-9
0.412
JAN-GHE-5a013bed-11
0.411
RUB-POS-1325a9ea-4
0.410
EDJ-MED-50fe53e8-4
0.407
JIN-POS-6dc588a4-6
0.407
JOH-UNI-6fede743-4
0.407
BEN-DND-02317c5c-9
0.407
PET-UNK-e274cad4-6
0.407
PET-UNK-f4e47ebd-1
0.407
CAR-UNK-140e3209-1
0.407
JAN-GHE-5a013bed-1
0.405
JIN-POS-6dc588a4-3
0.405
EDJ-MED-c8e7a002-6
0.405
EDJ-MED-c8e7a002-8
0.402
EDJ-MED-c8e7a002-17
0.402
RUB-POS-1325a9ea-3
0.402
MIC-UNK-50cce87d-3
0.402
RUB-POS-1325a9ea-5
0.402
PET-UNK-8df914d1-1
0.400
EDJ-MED-00c1612e-1
0.400
JAN-GHE-5a013bed-5
0.400
VLA-UCB-00f2c2b3-7
0.400
ALP-POS-3b848b35-3
0.400
JIN-POS-6dc588a4-23
0.398
RUB-POS-1325a9ea-8
0.398
RUB-POS-1325a9ea-15
0.398
JOH-UNI-abfda500-5
0.397
EDG-MED-0da5ad92-1
0.397
JAN-GHE-83b26c96-15
0.397
JOH-UNI-abfda500-4
0.397