Molecule Details
| Molecular Properties | |
| SMILES: | O=C(Nc1cncc2ccccc12)C1CN(C(=O)c2ncco2)Cc2ccc(Cl)cc21 |
| MW: | 432.1 |
| Fraction sp3: | 0.13 |
| HBA: | 5 |
| HBD: | 1 |
| Rotatable Bonds: | 3 |
| TPSA: | 88.33 |
| cLogP: | 4.25 |
| Covalent Warhead: | ✗ |
| Covalent Fragment: | ✗ |
| Activity Data | |
| IC50 (µM) - Fluorescence: | 0.918197839465401 |
| Order Status | |
| Ordered: | 2021-03-30 |
| Synthesis Location: | enamine |
| Shipped: | 2021-04-28 |
MAT-POS-4223bc15-36
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MAT-POS-4223bc15-40
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MAT-POS-dd3ad2b5-3
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PET-UNK-9b23ef84-2
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MAT-POS-dd3ad2b5-2
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MAT-POS-4223bc15-19
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RAL-THA-6e4c80cf-1
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MAT-POS-4223bc15-41
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MAT-POS-be048f2c-1
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MAT-POS-4223bc15-18
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MAT-POS-4223bc15-35
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MAT-POS-dd3ad2b5-5
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MAT-POS-4223bc15-17
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MAT-POS-4223bc15-37
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MAT-POS-be048f2c-3
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MAT-POS-4223bc15-39
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MAT-POS-be048f2c-2
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MAT-POS-be048f2c-4
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MAT-POS-4223bc15-20
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RAL-THA-6e4c80cf-2
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MAT-POS-4223bc15-33
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MAT-POS-dd3ad2b5-4
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MAT-POS-24589f88-3
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MAT-POS-24589f88-2
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BEN-DND-f2e727cd-6
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MAT-POS-dd3ad2b5-1
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RAL-THA-6e4c80cf-4
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ALF-EVA-0e90125c-1
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RAL-THA-ee48ba5f-5
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MAT-POS-4223bc15-21
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EDJ-MED-c40d95bc-2
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ALF-EVA-0e90125c-2
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MAT-POS-4223bc15-3
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EDJ-MED-12c4873b-5
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RAL-THA-952697e1-3
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RAL-THA-952697e1-4
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MAT-POS-777f5926-2
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VLA-UNK-5b0345c3-2
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MAT-POS-4223bc15-26
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MIC-UNK-482af05e-2
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MAT-POS-4223bc15-27
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PET-UNK-d61f3ea6-2
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MAT-POS-4223bc15-7
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VLA-UNK-5b0345c3-1
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MAT-POS-4223bc15-25
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PET-UNK-162c14b2-1
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MAT-POS-61f37a1a-12
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PET-UNK-9b23ef84-11
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RAL-THA-6e4c80cf-3
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MAT-POS-4223bc15-13
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RAL-THA-ee48ba5f-4
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MAT-POS-4223bc15-1
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EDJ-MED-e9a22d5d-1
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MAT-POS-4223bc15-6
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MIC-UNK-482af05e-1
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RAL-THA-ee48ba5f-2
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MAT-POS-4223bc15-32
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MAT-POS-4223bc15-23
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MAT-POS-4223bc15-2
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EDJ-MED-12c4873b-3
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MAT-POS-8293a91a-5
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MAT-POS-8293a91a-4
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PET-UNK-5ba9a1cb-3
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MAT-POS-4223bc15-30
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ALF-EVA-0e90125c-5
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MAT-POS-4223bc15-15
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RAL-THA-952697e1-2
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PET-UNK-9b23ef84-6
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MAT-POS-4223bc15-34
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PET-UNK-d61f3ea6-3
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EDJ-MED-12c4873b-7
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RAL-THA-952697e1-1
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PET-UNK-9b23ef84-14
0.598
BRU-THA-98e973b9-1
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BRU-THA-d60fe444-1
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EDJ-MED-fa7708b3-1
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RAL-THA-ee48ba5f-1
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MAT-UNK-35705829-1
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MAT-POS-4223bc15-22
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MAT-POS-4223bc15-24
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EDJ-MED-1981ceba-2
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BEN-DND-32596b04-7
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CLI-TLC-3a13eaf2-1
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MAT-POS-61f37a1a-2
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MAT-POS-4223bc15-9
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MAT-UNK-f490e871-1
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MAT-POS-5cd9ea36-3
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MAT-POS-5cd9ea36-19
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MAT-POS-5cd9ea36-20
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MAT-UNK-04ae9652-1
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ALF-EVA-0e90125c-9
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JOH-SUS-07b743f6-5
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MAT-POS-4223bc15-10
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JOH-SUS-07b743f6-7
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MAT-POS-4223bc15-8
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MAT-POS-4223bc15-28
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MAT-POS-5cd9ea36-17
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DAR-DIA-4987d2cd-2
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MAT-POS-4223bc15-5
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MAT-POS-5cd9ea36-2
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