Molecule Details
| Molecular Properties | |
| SMILES: | COc1ccccc1OCC(C)NC(=O)c1cc(=O)[nH]c2cc(F)ccc12 |
| MW: | 370.13 |
| Fraction sp3: | 0.2 |
| HBA: | 4 |
| HBD: | 2 |
| Rotatable Bonds: | 6 |
| TPSA: | 80.42 |
| cLogP: | 2.87 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Source | |
| Enamine REAL: | Z1245992131 |
| MolPort: | MolPort-047-552-982 |
| Activity Data | |
| IC50 (µM) - Fluorescence: | 33.6696856300625 |
| Trypsin IC50 (µM): | 99.0 |
| Order Status | |
| Ordered: | 2020-05-17 |
| Synthesis Location: | enamine |
| Shipped: | 2020-06-10 |
AAR-POS-d2a4d1df-1
MAT-POS-590ac91e-41
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MAT-POS-590ac91e-32
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MAT-POS-590ac91e-38
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MAT-POS-590ac91e-37
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DAR-DIA-8e329c92-6
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DAR-DIA-8e329c92-4
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DAR-DIA-8e329c92-5
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DAR-DIA-8e329c92-7
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DAR-DIA-8e329c92-8
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MAT-POS-590ac91e-36
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MAT-POS-916a2c5a-2
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MAT-POS-590ac91e-31
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ALP-UNI-ed5cdfd2-2
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MAT-POS-590ac91e-49
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MAT-POS-590ac91e-39
0.420
MAT-POS-590ac91e-46
0.413
MAT-POS-590ac91e-42
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BEN-DND-7e92b6ca-2
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EDJ-MED-6af13d92-2
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MAT-POS-590ac91e-34
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MAT-UCB-70f7c0f7-4
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MAT-POS-590ac91e-50
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EDJ-MED-6af13d92-3
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MAR-UCB-f313ec4d-4
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MAT-UCB-70f7c0f7-3
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ADA-UCB-b1b30a00-2
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EDJ-MED-6af13d92-1
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MAT-POS-590ac91e-65
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ADA-UCB-6c2cb422-8
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MAT-POS-590ac91e-57
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ALP-UNI-ed5cdfd2-1
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MAR-UCB-f313ec4d-1
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ALP-POS-fc6c627f-3
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MAT-POS-590ac91e-61
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MAT-POS-590ac91e-43
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ALP-POS-05819dc4-1
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ERI-UCB-a0b0dbcb-9
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BEN-DND-7e92b6ca-1
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ALP-POS-3fc1724e-1
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MAT-POS-35d3f55a-2
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KEI-TRE-fa9ada3e-3
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EDJ-MED-bbe8e3da-3
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MAT-POS-590ac91e-63
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ERI-UCB-a0b0dbcb-5
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ERI-UCB-a0b0dbcb-6
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MAT-POS-8fd29122-1
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DAR-DIA-8e329c92-10
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MAT-POS-590ac91e-48
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MAT-POS-590ac91e-60
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ALP-UNI-ed5cdfd2-3
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MAT-POS-590ac91e-35
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BEN-DND-7e92b6ca-13
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ERI-UCB-a0b0dbcb-8
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EDJ-MED-bbe8e3da-4
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EDJ-MED-bbe8e3da-2
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BEN-DND-7e92b6ca-5
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DAR-DIA-8e329c92-3
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EDJ-MED-edeb0d3a-1
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BEN-DND-b89db3f2-5
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EDJ-MED-bbe8e3da-1
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ALP-UNI-ed5cdfd2-6
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MAT-POS-590ac91e-30
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JOH-UNI-abfda500-3
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DAR-DIA-8e329c92-2
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BEN-DND-7e92b6ca-14
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ALP-POS-19e898d3-1
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MAT-POS-590ac91e-47
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BEN-DND-7e92b6ca-15
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DAR-DIA-8e329c92-1
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ERI-UCB-ce40166b-25
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BEN-DND-7e92b6ca-4
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MAT-UCB-70f7c0f7-1
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ADA-UCB-b1b30a00-1
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BEN-DND-7e92b6ca-11
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KRI-MAR-d2e3ef86-13
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NAU-LAT-a5c7d7cb-7
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KRI-MAR-d2e3ef86-15
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MAR-TRE-799db12b-12
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MAT-POS-3b536971-1
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EDJ-MED-edeb0d3a-2
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BEN-DND-7e92b6ca-3
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MAT-POS-54c4bf04-1
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MAT-POS-590ac91e-33
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ERI-UCB-ce40166b-15
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PET-UNK-752bebd6-1
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MAT-POS-91829f0d-1
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MAR-UCB-f313ec4d-2
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ERI-UCB-ce40166b-14
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LON-WEI-1908424e-9
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ADA-UCB-6c2cb422-9
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MAT-POS-590ac91e-54
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ALP-POS-3fc1724e-4
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VLA-UNK-eaa804fd-3
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MAR-UCB-f313ec4d-3
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MAT-POS-3b92565d-4
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MAT-POS-e1b5ac6b-2
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MAT-POS-35d3f55a-1
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EDJ-MED-d1cd9639-1
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ALP-POS-19e898d3-2
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MAT-UCB-70f7c0f7-2
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