Molecular Properties | |
SMILES: | CCc1nnc(NC(=O)CSc2ncccc2C#N)s1 |
MW: | 305.04 |
Fraction sp3: | 0.25 |
HBA: | 7 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 91.56 |
cLogP: | 2.1 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-1253280918 |
MolPort: | MolPort-002-312-954 |
MAR-TRE-6c5ef77a-26
0.725
MAR-TRE-a3327163-15
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MAR-TRE-6c5ef77a-14
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MAR-TRE-1c920f6f-42
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MAR-TRE-0fda4e82-47
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MAR-TRE-1c920f6f-47
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MAR-TRE-6c5ef77a-64
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MAR-TRE-6c5ef77a-66
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MAR-TRE-14ce9fd6-43
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MAR-TRE-6c5ef77a-67
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MAR-TRE-0fda4e82-76
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MAR-TRE-14ce9fd6-27
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MAR-TRE-1c920f6f-30
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MAR-TRE-1c920f6f-74
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MAR-TRE-0fda4e82-89
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MAR-TRE-6c5ef77a-58
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MAR-TRE-6c5ef77a-46
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MAR-TRE-0fda4e82-90
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MAR-TRE-1c920f6f-26
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MAR-TRE-1c920f6f-44
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MAR-TRE-6c5ef77a-96
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MAR-TRE-0fda4e82-68
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MAR-TRE-0fda4e82-36
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MAR-TRE-14ce9fd6-1
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MAR-TRE-6c5ef77a-51
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MAR-TRE-1c920f6f-10
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MAR-TRE-6c5ef77a-93
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MAR-TRE-6c5ef77a-19
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MAR-TRE-0fda4e82-63
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MAR-TRE-1c920f6f-82
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MAR-TRE-6c5ef77a-40
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MAR-TRE-a3327163-61
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MAR-TRE-6c5ef77a-68
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MAR-TRE-a3327163-29
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MAR-TRE-a3327163-50
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MAR-TRE-a3327163-20
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MAR-TRE-a3327163-34
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MAR-TRE-0fda4e82-31
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MAR-TRE-a3327163-88
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ANT-DIA-3c79be55-1
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MAR-TRE-a3327163-24
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MAR-TRE-a3327163-82
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MAR-TRE-fd17a9b8-23
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MAR-TRE-a3327163-37
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MAR-TRE-fd17a9b8-43
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MAR-TRE-74c6519b-44
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MAR-TRE-1c920f6f-95
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MAR-TRE-a3327163-18
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ANT-DIA-3c79be55-3
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MAR-TRE-6c5ef77a-28
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MAR-TRE-6c5ef77a-47
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MAR-TRE-1c920f6f-75
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MAR-TRE-0fda4e82-81
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MAR-TRE-a3327163-5
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MAR-TRE-a3327163-42
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MAR-TRE-a3327163-53
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MAR-TRE-0fda4e82-20
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MAR-TRE-1c920f6f-96
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MAR-TRE-1c920f6f-46
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MAR-TRE-14ce9fd6-36
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MAR-TRE-a3327163-92
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MAR-TRE-1c920f6f-7
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MAR-TRE-6c5ef77a-17
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MAR-TRE-a9136c7b-43
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MAR-TRE-a3327163-11
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MAR-TRE-0fda4e82-30
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MAR-TRE-6c5ef77a-92
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MAR-TRE-0fda4e82-96
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MAR-TRE-0fda4e82-24
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MAR-TRE-6c5ef77a-12
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MAR-TRE-14ce9fd6-4
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MAR-TRE-a3327163-6
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