Molecular Properties | |
SMILES: | C=CC(=O)N(C(=O)Cc1cc(C#N)cc(OC2CC(=O)N2)c1)c1cccnc1 |
MW: | 376.12 |
Fraction sp3: | 0.15 |
HBA: | 6 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 112.39 |
cLogP: | 1.47 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
acyclic_imide
betalactam
b-lactam
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TRY-UNI-69298daf-4
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TRY-UNI-69298daf-2
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TRY-UNI-69298daf-5
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TRY-UNI-69298daf-3
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RAL-THA-901e9a10-3
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TRY-UNI-2eddb1ff-6
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TRY-UNI-69298daf-1
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PET-UNK-e8c7a26f-2
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RAL-THA-901e9a10-4
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TRY-UNI-bbd40bb4-1
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TRY-UNI-bbd40bb4-2
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ERI-UCB-ce40166b-9
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RAL-THA-901e9a10-5
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RAL-THA-901e9a10-6
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TRY-UNI-2eddb1ff-7
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WIL-MOD-03b86a88-1
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ALP-POS-a30bcdb4-1
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RAL-MED-2de63afb-1
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RAL-THA-901e9a10-1
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MAT-POS-3b92565d-3
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EDJ-MED-7320d5d2-1
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ALP-POS-3b848b35-2
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RAL-THA-065e0743-2
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RAL-THA-901e9a10-2
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ALF-EVA-0b412456-1
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ERI-UCB-ce40166b-10
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BEN-DND-b89db3f2-3
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BRU-LEF-c49414a7-1
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RAL-MED-2de63afb-5
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MIC-SGC-657978c3-5
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MAT-POS-3b92565d-6
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MAR-UCB-ad2ff052-2
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TRY-UNI-bbd40bb4-4
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TRY-UNI-2eddb1ff-8
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DAR-DIA-076fb6ea-2
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LON-WEI-adc59df6-65
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PET-UNK-cf04cb02-1
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DAR-DIA-1d7f034a-1
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ALF-EVA-650655fc-3
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RAL-MED-2de63afb-10
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ALP-POS-3fc1724e-6
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ERI-UCB-ce40166b-12
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FRA-DIA-b66f7109-2
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FRA-DIA-b66f7109-1
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MIC-SGC-657978c3-6
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LON-WEI-adc59df6-78
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MAT-POS-53907a1c-3
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DAR-DIA-667e571f-4
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RYA-UNI-8a7f7a0d-1
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JOR-UNI-61e7b1d5-9
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DAR-DIA-667e571f-7
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DAR-DIA-23e5a6a0-30
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LON-WEI-adc59df6-83
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WIL-UNI-5578df48-35
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JAN-GHE-f4ca5a00-15
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ANN-UNI-26382800-5
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DAR-DIA-667e571f-1
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RAY-UNI-5365d7e5-1
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DAR-DIA-667e571f-2
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LON-WEI-adc59df6-68
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SAD-SAT-24589cd1-9
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LON-WEI-adc59df6-87
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