Molecular Properties | |
SMILES: | CC(=O)Nc1cccc(N2CCNC2=O)c1 |
MW: | 219.1 |
Fraction sp3: | 0.27 |
HBA: | 2 |
HBD: | 2 |
Rotatable Bonds: | 2 |
TPSA: | 61.44 |
cLogP: | 1.17 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Source | |
Enamine Extended REAL: | s_22____774648____58844 |
MolPort: | MolPort-020-364-432 |
LON-WEI-8f408cad-3
MAK-UNK-c8c8f7e2-14
1.000
MAK-UNK-6435e6c2-4
0.589
MAK-UNK-7a704a63-3
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MAK-UNK-c8c8f7e2-42
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MAK-UNK-c8c8f7e2-30
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MAK-UNK-c8c8f7e2-43
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MAR-TRE-a9136c7b-57
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MAK-UNK-c8c8f7e2-44
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MAK-UNK-7a704a63-1
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MAK-UNK-7a704a63-12
0.452
MAK-UNK-7a704a63-8
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MAK-UNK-7a704a63-13
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MAK-UNK-c8c8f7e2-15
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MAK-UNK-c8c8f7e2-27
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MAK-UNK-c8c8f7e2-28
0.439
MAK-UNK-7a704a63-14
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MAK-UNK-c8c8f7e2-21
0.438
MAK-UNK-c8c8f7e2-16
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MAK-UNK-7a704a63-9
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MAK-UNK-c8c8f7e2-22
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MAK-UNK-c8c8f7e2-24
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MAK-UNK-c8c8f7e2-29
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MAK-UNK-7a704a63-15
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MAK-UNK-c8c8f7e2-17
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MAK-UNK-c8c8f7e2-18
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LON-WEI-8f408cad-1
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MAK-UNK-7a704a63-10
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MAK-UNK-10dfa458-3
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MAR-TRE-799db12b-36
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MAK-UNK-c8c8f7e2-10
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MAK-UNK-7a704a63-5
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BAR-COM-0f94fc3d-53
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MAR-TRE-a9136c7b-42
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BAR-COM-4e090d3a-60
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MAK-UNK-9159f8ed-6
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MAK-UNK-902cc841-3
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WIL-LEE-23e8b574-8
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MAK-UNK-1e8f9e3c-3
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MAK-UNK-9159f8ed-2
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MAR-TRE-2fd8122f-39
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LON-WEI-120e5cf5-4
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MAK-UNK-c8c8f7e2-11
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MAK-UNK-c8c8f7e2-39
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MAK-UNK-c8c8f7e2-3
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MAK-UNK-7a704a63-16
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MAK-UNK-7a704a63-6
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MAK-UNK-9159f8ed-3
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AAR-UNI-c25c2f1e-61
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MAK-UNK-10dfa458-25
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MAK-UNK-9159f8ed-1
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RAL-MED-2de63afb-10
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MAK-UNK-9159f8ed-4
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SAD-SAT-24589cd1-2
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LON-WEI-b2874fec-9
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MAK-UNK-7a704a63-22
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RAL-MED-2de63afb-11
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MAK-UNK-c8c8f7e2-1
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MAK-UNK-7a704a63-17
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MAK-UNK-7a704a63-20
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MAK-UNK-c8c8f7e2-40
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SWA-SYN-6423ea73-9
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IND-SYN-6c8299e8-8
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MAK-UNK-c8c8f7e2-2
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MAK-UNK-7a704a63-11
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MAK-UNK-c8c8f7e2-4
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MAK-UNK-c8c8f7e2-12
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MAK-UNK-7a704a63-7
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MAK-UNK-5d2caa6f-17
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RAL-MED-2de63afb-9
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MAK-UNK-c8c8f7e2-6
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LON-WEI-120e5cf5-19
0.282
MAK-UNK-c8c8f7e2-41
0.282
MAK-UNK-7a704a63-18
0.282
MAK-UNK-10dfa458-32
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MAK-UNK-129dcd6f-2
0.280
MAK-UNK-c8c8f7e2-5
0.280
WIL-UNI-1faa9b10-23
0.276
AME-UNI-e7596d22-1
0.276
MAK-UNK-c8c8f7e2-38
0.274
SWA-SYN-d2e6fa14-8
0.274
SWA-SYN-6423ea73-8
0.274
BAR-COM-4e090d3a-58
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MAR-TRE-799db12b-69
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MAR-TRE-66ac689e-72
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