Molecular Properties | |
SMILES: | O=C(Cc1cc(Cl)cc(OC2CC(=O)N2)c1)Nc1cc(=O)[nH]c2ccccc12 |
MW: | 397.08 |
Fraction sp3: | 0.15 |
HBA: | 4 |
HBD: | 3 |
Rotatable Bonds: | 5 |
TPSA: | 100.29 |
cLogP: | 2.59 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 83.2810282152651 |
IC50 (µM) - RapidFire: | 99.0 |
Order Status | |
Ordered: | 2020-07-25 |
Synthesis Location: | enamine |
Shipped: | 2020-09-01 |
betalactam
b-lactam
MAT-POS-3b92565d-5
0.720
ALP-POS-3b848b35-2
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EDJ-MED-7320d5d2-1
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MAT-POS-3b92565d-3
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MAT-POS-3b92565d-9
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ALP-POS-a30bcdb4-1
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ROB-UNI-daaf9793-1
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MAT-POS-e1b5ac6b-1
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RAL-THA-065e0743-2
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TRY-UNI-2eddb1ff-7
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WIL-MOD-03b86a88-1
0.548
BEN-DND-b89db3f2-3
0.533
MAT-POS-9ff17035-1
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ALF-EVA-0b412456-1
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ALF-EVA-0b412456-3
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ALF-EVA-0b412456-4
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MAT-POS-3b92565d-4
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MAT-POS-e1b5ac6b-2
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ALF-EVA-0b412456-5
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ALF-EVA-0b412456-2
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ALF-EVA-0b412456-6
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ALF-EVA-0b412456-7
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JAN-GHE-74b8b0cb-1
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PET-UNK-cf04cb02-1
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ALF-EVA-0b412456-8
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NAU-LAT-30527ac5-3
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ALP-POS-3fc1724e-2
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ERI-UCB-ce40166b-17
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NAU-LAT-a5c7d7cb-9
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MAT-POS-3b92565d-12
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MAT-POS-c478e61b-1
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FRA-DIA-0fa076fe-3
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MAT-UCB-93f6aed8-1
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NAU-LAT-30527ac5-6
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DAR-DIA-23e5a6a0-30
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ERI-UCB-ce40166b-18
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MAR-UCB-f313ec4d-1
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DAR-DIA-23e5a6a0-24
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ERI-UCB-ce40166b-5
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ADA-UCB-6c2cb422-11
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DAR-DIA-23e5a6a0-22
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JAG-UCB-c61058a9-45
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FRA-DIA-e29753f2-1
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NAU-LAT-b7d8c353-3
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VLA-UCB-05e51b3f-18
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VLA-UCB-50c39ae8-11
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ADA-UCB-6c2cb422-8
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BEN-DND-b89db3f2-1
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DAR-DIA-53551c05-16
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DAR-DIA-23e5a6a0-26
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FRA-DIA-0fa076fe-4
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MAT-UCB-93f6aed8-2
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DAR-DIA-23e5a6a0-28
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ADA-UCB-6c2cb422-10
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RAL-THA-901e9a10-1
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WIL-MOD-03b86a88-4
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MAT-POS-3b92565d-8
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RAL-THA-901e9a10-6
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RAL-THA-901e9a10-5
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DAR-DIA-0587064e-3
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RAL-THA-901e9a10-2
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ERI-UCB-ce40166b-13
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DAR-DIA-53551c05-15
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RAL-THA-2d450e86-18
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ALP-POS-3b848b35-1
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MAT-POS-3b92565d-2
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MAT-UCB-70f7c0f7-5
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ALF-EVA-650655fc-1
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RAL-THA-901e9a10-3
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RAL-THA-901e9a10-4
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TRY-UNI-2eddb1ff-6
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MAT-POS-9ff17035-2
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MAT-POS-173a45da-2
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RYA-UNI-8a7f7a0d-1
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ALF-EVA-650655fc-2
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EDJ-MED-50011917-1
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ERI-UCB-ce40166b-21
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ALP-POS-a30bcdb4-2
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ALF-EVA-650655fc-3
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EDJ-MED-50011917-2
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PET-UNK-8c422e11-3
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MIC-UNK-16ccb665-1
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MAT-POS-9ff17035-3
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RAL-THA-1d44ff04-12
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RAL-MED-2de63afb-6
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MAT-POS-53907a1c-3
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PET-UNK-bb7ffe78-2
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ERI-UCB-ce40166b-6
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RAL-THA-901e9a10-7
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BRU-LEF-c49414a7-1
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DAR-DIA-0587064e-7
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DAR-DIA-667e571f-1
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CHO-MSK-6e55470f-20
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FRA-DIA-b66f7109-2
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ALF-EVA-650655fc-6
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PET-UNK-8c422e11-4
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DAR-DIA-0587064e-4
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DAR-DIA-0587064e-2
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ALP-POS-fab80cf2-1
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RAL-THA-1d44ff04-1
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