Molecular Properties | |
SMILES: | COc1ccc(CSc2nc(C)cc(C)c2C#N)cc1 |
MW: | 284.1 |
Fraction sp3: | 0.25 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 4 |
TPSA: | 45.91 |
cLogP: | 3.87 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-5416260478 |
MolPort: | MolPort-000-466-868 |
MAR-TRE-14ce9fd6-50
0.678
MAR-TRE-14ce9fd6-57
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MAR-TRE-1c920f6f-94
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MAR-TRE-0fda4e82-30
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MAR-TRE-1c920f6f-14
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MAR-TRE-a3327163-21
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MAR-TRE-a3327163-25
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MAR-TRE-a3327163-11
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MAR-TRE-1c920f6f-81
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MAR-TRE-1c920f6f-53
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MAR-TRE-1c920f6f-29
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MAR-TRE-1c920f6f-70
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MAR-TRE-a3327163-41
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MAR-TRE-1c920f6f-100
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MAR-TRE-a3327163-29
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MAR-TRE-1c920f6f-20
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MAR-TRE-a3327163-80
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MAR-TRE-1c920f6f-95
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MAR-TRE-14ce9fd6-65
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MAR-TRE-0fda4e82-69
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MAR-TRE-a3327163-60
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MAR-TRE-14ce9fd6-53
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MAR-TRE-a3327163-82
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MAR-TRE-14ce9fd6-9
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MAR-TRE-6c5ef77a-18
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MAR-TRE-a3327163-70
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MAR-TRE-6c5ef77a-60
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MAR-TRE-14ce9fd6-93
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MAR-TRE-14ce9fd6-90
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MAR-TRE-6c5ef77a-17
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MAR-TRE-14ce9fd6-41
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MAR-TRE-6c5ef77a-5
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MAR-TRE-1c920f6f-59
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MAR-TRE-1c920f6f-31
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MAR-TRE-0fda4e82-19
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MAR-TRE-6c5ef77a-65
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MAR-TRE-1c920f6f-61
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MAR-TRE-a3327163-63
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MAR-TRE-a3327163-24
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MAR-TRE-14ce9fd6-44
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MAR-TRE-14ce9fd6-29
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MAR-TRE-a3327163-37
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MAT-POS-ea426761-10
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LON-WEI-4d77710c-68
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MAR-TRE-14ce9fd6-83
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MAR-TRE-a3327163-95
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MAR-TRE-a3327163-40
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MAR-TRE-e86a56b5-64
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MAR-TRE-85681e92-91
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MAR-TRE-14ce9fd6-42
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MAR-TRE-1c920f6f-96
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DRA-CSI-47e38074-8
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MAR-TRE-0fda4e82-12
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MAR-TRE-14ce9fd6-8
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