Molecular Properties | |
SMILES: | O=C(Nc1cncc2ccc(CN3CC4(CNC4)C3)cc12)C1CCOc2ccc(Cl)cc21 |
MW: | 448.17 |
Fraction sp3: | 0.36 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 66.49 |
cLogP: | 3.8 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 1.47383802392777 |
Order Status | |
Shipped: | 2021-07-15 |
MAT-POS-86c60949-3
1.000
MAT-POS-7ddaf7de-3
0.784
ERI-UCB-8d4e5055-6
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ERI-UCB-8d4e5055-2
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MAT-POS-8695a11f-2
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ALP-POS-82da25a3-2
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MAK-UNK-8be7dca9-8
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EDG-MED-5d232de5-1
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EDG-MED-5d232de5-2
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EDJ-MED-ba7e64f2-1
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BEN-DND-c852c98b-4
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ALP-POS-696356e4-1
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ALP-POS-ce760d3f-7
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ERI-UCB-b3e6b0c2-6
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MAT-POS-f9802937-7
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ALF-EVA-5b152d2f-2
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BEN-DND-c852c98b-2
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MAK-UNK-8be7dca9-7
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ERI-UCB-8d4e5055-1
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MAK-UNK-8be7dca9-1
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PET-UNK-ee8352fa-4
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MAT-POS-8293a91a-3
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BEN-DND-c852c98b-3
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BEN-DND-c852c98b-5
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ERI-UCB-8d4e5055-4
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BEN-DND-c852c98b-6
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MAK-UNK-8be7dca9-4
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BEN-DND-c852c98b-1
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BEN-DND-c852c98b-7
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MAT-POS-419aafdb-1
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RAL-THA-b9d6aec1-3
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ALF-EVA-5b152d2f-7
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MAT-POS-b3e365b9-1
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VLA-UCB-1dbca3b4-15
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MAT-POS-f7918075-1
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MAT-POS-b3e365b9-2
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MAT-POS-419aafdb-2
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RAL-THA-b9d6aec1-2
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RAL-THA-b9d6aec1-1
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BEN-DND-4f474d93-2
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ALP-POS-ce760d3f-3
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ALP-POS-82da25a3-1
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MAK-UNK-8be7dca9-2
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ALF-EVA-5b152d2f-8
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BEN-DND-4f474d93-1
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BEN-DND-4f474d93-3
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ALP-POS-ce760d3f-2
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MAK-UNK-8be7dca9-5
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RUB-POS-1325a9ea-10
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PET-UNK-b38839dc-4
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WIL-UCB-7ba4ac3a-1
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PET-UNK-ee8352fa-5
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JAG-UCB-571deb56-6
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ALF-EVA-5b152d2f-3
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PET-UNK-03fd2068-1
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JAG-UCB-571deb56-3
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MAT-POS-7ddaf7de-1
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PET-UNK-ee8352fa-6
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JAG-UCB-571deb56-5
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MAT-POS-14f31916-5
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PET-UNK-f4e47ebd-3
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PET-UNK-b38839dc-5
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JAG-UCB-571deb56-2
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PET-UNK-b1ef24dc-7
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MIC-UNK-7574fcc6-2
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MAK-UNK-8be7dca9-9
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ERI-UCB-b3e6b0c2-1
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ALF-EVA-5b152d2f-5
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MAT-POS-1ecf5680-1
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JAG-UCB-571deb56-4
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TET-ENA-382364b7-1
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PET-UNK-b1ef24dc-8
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ADA-UCB-dc2b944c-8
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ERI-UCB-8d4e5055-3
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MAT-POS-7ddaf7de-2
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PET-UNK-6314f867-1
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JAG-UCB-571deb56-1
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PET-UNK-b38839dc-3
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MAT-POS-14f31916-1
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MAT-POS-d8472c4f-6
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MAT-POS-1ecf5680-2
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PET-UNK-7f7e354d-1
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MAT-POS-8040981b-1
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PET-UNK-f4e47ebd-4
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JAG-UCB-571deb56-7
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MAT-POS-a2421bb6-3
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ERI-UCB-b3e6b0c2-4
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NAU-LAT-b7d8c353-8
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MAK-UNK-8be7dca9-6
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PET-UNK-e274cad4-2
0.500
ERI-UCB-b3e6b0c2-5
0.500
TET-ENA-1a76f195-1
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MAT-POS-ee5e8e94-1
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EDJ-MED-fb4b7746-4
0.496
EDG-MED-0e5afe9d-1
0.496
MAT-POS-acfe5bae-5
0.495
MAT-POS-14f31916-2
0.495
NAU-LAT-b7d8c353-2
0.495
MIC-UNK-b904ca85-2
0.495
PET-UNK-e274cad4-7
0.495