Molecular Properties | |
SMILES: | COc1ccc(NC(=O)CSc2ncc3c(c2C#N)CCC3)cc1 |
MW: | 339.1 |
Fraction sp3: | 0.28 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 5 |
TPSA: | 75.01 |
cLogP: | 3.18 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-2346124509 |
MolPort: | MolPort-002-102-988 |
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MAR-TRE-0fda4e82-6
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MAR-TRE-6c5ef77a-12
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MAR-TRE-6c5ef77a-26
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MAR-TRE-a3327163-80
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RAL-MED-9a5eb9cb-13
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MAR-TRE-1c920f6f-51
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MAR-TRE-6c5ef77a-96
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DRA-CSI-7ec17797-14
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MAR-TRE-0fda4e82-18
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RAL-MED-9a5eb9cb-1
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