Molecular Properties | |
SMILES: | CC(C)[C@@H](N)C(=O)Nc1ccc(N2CCOCC2)nc1 |
MW: | 278.17 |
Fraction sp3: | 0.57 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 80.48 |
cLogP: | 0.84 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
MolPort: | MolPort-027-089-441 |
MAR-TRE-9c797165-83
0.733
MAR-TRE-9c797165-58
0.646
MAR-TRE-9c797165-32
0.614
MAR-TRE-9c797165-69
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MAR-TRE-67513f76-64
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MAR-TRE-4b834d9a-64
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MAR-TRE-67513f76-60
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MAR-TRE-9c797165-28
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MAR-TRE-7f7bb9f0-37
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MAR-TRE-6a44bbf2-67
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MAR-TRE-f6f5f473-76
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MAR-TRE-d0525fbf-87
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MAR-TRE-3159af1a-17
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MAR-TRE-f5c2d31c-96
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MAR-TRE-f5c2d31c-38
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MAR-TRE-3e4e6814-57
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MAR-TRE-fd17a9b8-49
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MAR-TRE-f5c2d31c-70
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MAR-TRE-f5c2d31c-99
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MAR-TRE-67513f76-9
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MAR-TRE-9c797165-37
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MAR-TRE-7f7bb9f0-11
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MAR-TRE-f5c2d31c-74
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MAR-TRE-f5c2d31c-42
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MAR-TRE-f5c2d31c-81
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MAR-TRE-67513f76-74
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MAR-TRE-9c797165-90
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MAR-TRE-7f7bb9f0-47
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MAR-TRE-f6f5f473-28
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MAR-TRE-9c797165-13
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MAR-TRE-d0525fbf-99
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MAR-TRE-f5c2d31c-52
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WIL-LEE-23e8b574-8
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MAR-TRE-3e4e6814-13
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MAR-TRE-b77b7921-30
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MAR-TRE-f5c2d31c-18
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MAR-TRE-9c797165-3
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MAR-TRE-67513f76-84
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MAR-TRE-3e4e6814-16
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MAR-TRE-67513f76-89
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MAR-TRE-b77b7921-9
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MAR-TRE-f5c2d31c-35
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MAR-TRE-f5c2d31c-13
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MAR-TRE-74c6519b-96
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MAR-TRE-67513f76-47
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JOH-UNI-522b0723-10
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MAR-TRE-67513f76-21
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MAR-TRE-f5c2d31c-28
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MAR-TRE-2fd8122f-89
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MAR-TRE-9c797165-67
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MAR-TRE-f5c2d31c-85
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MAR-TRE-fd17a9b8-85
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MAR-TRE-67513f76-12
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MAR-TRE-67513f76-16
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MAR-TRE-67513f76-80
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MAR-TRE-f5c2d31c-36
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MAR-TRE-f5c2d31c-20
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JOH-UNI-abdb2f0c-1
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MAR-TRE-f6f5f473-63
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MAR-TRE-67513f76-75
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MAR-TRE-f5c2d31c-19
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MAR-TRE-67513f76-53
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MAR-TRE-f6f5f473-56
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MAR-TRE-f5c2d31c-37
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MAR-TRE-74c6519b-52
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MAR-TRE-9c797165-43
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MAR-TRE-74c6519b-90
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MAR-TRE-f5c2d31c-27
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BAR-COM-4e090d3a-58
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MAR-TRE-3159af1a-71
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MAR-TRE-7f7bb9f0-82
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MAR-TRE-2fd8122f-96
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MAK-UNK-de8f6d00-8
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MAR-TRE-f5c2d31c-57
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MAR-TRE-9c797165-16
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MAR-TRE-4b834d9a-46
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MAR-TRE-f6f5f473-98
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MAR-TRE-fd17a9b8-97
0.263
MAR-TRE-b77b7921-35
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MAR-TRE-2fd8122f-88
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MAR-TRE-f5c2d31c-9
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MAR-TRE-f5c2d31c-29
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MAR-TRE-3159af1a-52
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MAR-TRE-7f7bb9f0-98
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MAR-TRE-f5c2d31c-11
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MAR-TRE-f5c2d31c-22
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MAR-TRE-f5c2d31c-66
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ALP-POS-bad7201a-8
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MAR-TRE-f5c2d31c-7
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MAR-TRE-fd17a9b8-72
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MAR-TRE-c317dd82-96
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MAR-TRE-3e4e6814-34
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KEI-TRE-d5e2018a-32
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MAR-TRE-f6f5f473-8
0.253
MAR-TRE-b77b7921-95
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MAR-TRE-67513f76-1
0.253
BEN-DND-93268d01-10
0.250