Molecular Properties | |
SMILES: | O=C(Cc1ccccc1Cl)NCCn1c(=O)n(Cc2ccc(F)cc2)c2cccnc21 |
MW: | 438.13 |
Fraction sp3: | 0.17 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 7 |
TPSA: | 68.92 |
cLogP: | 3.4 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-7784165717 |
MolPort: | MolPort-028-859-262 |
MAR-TRE-f6f5f473-61
0.821
MAR-TRE-d0525fbf-88
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MAR-TRE-04c86cea-54
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MAR-TRE-74c6519b-11
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MAR-TRE-3e4e6814-71
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MAR-TRE-4b834d9a-76
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MAR-TRE-3e4e6814-70
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MAR-TRE-f6f5f473-42
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MAR-TRE-04c86cea-14
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MAR-TRE-4b834d9a-55
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MAR-TRE-3e4e6814-51
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MAR-TRE-4b834d9a-95
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MAR-TRE-04c86cea-55
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MAR-TRE-04c86cea-69
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MAR-TRE-f6f5f473-41
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MAR-TRE-3e4e6814-94
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MAR-TRE-3e4e6814-90
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MAR-TRE-04c86cea-73
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MAR-TRE-d0525fbf-12
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MAR-TRE-04c86cea-74
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MAR-TRE-04c86cea-92
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MAR-TRE-f6f5f473-50
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MAR-TRE-4b834d9a-54
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MAR-TRE-d0525fbf-29
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MAR-TRE-04c86cea-12
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MAR-TRE-b77b7921-43
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MAR-TRE-74c6519b-20
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MAR-TRE-4b834d9a-35
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MAR-TRE-d0525fbf-60
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MAR-TRE-d0525fbf-17
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MAR-TRE-9c797165-78
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MAR-TRE-7f7bb9f0-71
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MAR-TRE-f6f5f473-17
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MAR-TRE-74c6519b-4
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MAR-TRE-3e4e6814-73
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MAR-TRE-d0525fbf-11
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MAR-TRE-67513f76-11
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MAR-TRE-b77b7921-27
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MAR-TRE-d0525fbf-43
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MAR-TRE-9c797165-23
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MAR-TRE-4b834d9a-14
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MAR-TRE-d0525fbf-1
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MAR-TRE-4b834d9a-11
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MAR-TRE-d0525fbf-70
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MAR-TRE-7f7bb9f0-70
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MAR-TRE-b77b7921-14
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MAR-TRE-d0525fbf-71
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MAR-TRE-4b834d9a-18
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MAR-TRE-4b834d9a-69
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MAR-TRE-74c6519b-78
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MAR-TRE-7f7bb9f0-73
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MAR-TRE-f6f5f473-12
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MAR-TRE-d0525fbf-67
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MAR-TRE-7f7bb9f0-78
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MAR-TRE-4b834d9a-36
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MAR-TRE-b77b7921-32
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MAR-TRE-4b834d9a-2
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MAR-TRE-67513f76-72
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MAR-TRE-74c6519b-70
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MAR-TRE-b77b7921-64
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MAR-TRE-74c6519b-1
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MAR-TRE-f6f5f473-92
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MAR-TRE-d0525fbf-3
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MAR-TRE-74c6519b-2
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MAR-TRE-b77b7921-20
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MAR-TRE-f6f5f473-40
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MAR-TRE-9c797165-85
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MAR-TRE-d0525fbf-28
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MAR-TRE-04c86cea-21
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MAR-TRE-3e4e6814-75
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MAR-TRE-74c6519b-87
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MAR-TRE-b77b7921-7
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MAR-TRE-4b834d9a-15
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