Molecular Properties | |
SMILES: | O=C(NC[C@@]1(C(=O)Nc2cncc3ccccc23)CCOc2ccc(Cl)cc21)C1(CO)CCC1 |
MW: | 479.16 |
Fraction sp3: | 0.35 |
HBA: | 5 |
HBD: | 3 |
Rotatable Bonds: | 6 |
TPSA: | 100.55 |
cLogP: | 3.83 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Long aliphatic chain
EDJ-MED-40433386-10
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MAT-POS-e6dd326d-12
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MAT-POS-e6dd326d-9
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MAT-POS-e6dd326d-8
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MAT-POS-45b13633-2
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MAT-POS-e6dd326d-11
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EDJ-MED-f893e2a1-8
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EDJ-MED-424a8a89-2
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EDG-MED-971238d3-2
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EDG-MED-70ae9412-2
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EDJ-MED-4c7486ba-1
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MAT-POS-e6dd326d-7
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EDJ-MED-4c7486ba-4
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MAT-POS-e6dd326d-4
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MAT-POS-e6dd326d-10
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EDJ-MED-40433386-5
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EDJ-MED-40433386-8
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RAL-THA-58fba2bc-3
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EDG-MED-971238d3-3
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EDJ-MED-15e90dfc-3
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EDJ-MED-424a8a89-1
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MAT-POS-e6dd326d-13
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EDJ-MED-15e90dfc-7
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EDJ-MED-15e90dfc-4
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MAT-POS-e6dd326d-5
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EDG-MED-971238d3-9
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JAG-UCB-706446eb-3
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MAT-POS-45b13633-4
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EDG-MED-971238d3-10
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EDJ-MED-15e90dfc-5
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MAT-POS-e6dd326d-1
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EDJ-MED-f893e2a1-1
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EDJ-MED-4c7486ba-6
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EDJ-MED-4c7486ba-2
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EDJ-MED-4c7486ba-5
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EDG-MED-971238d3-6
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EDJ-MED-f893e2a1-9
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ALP-UNI-0676e700-16
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DAR-DIA-ecdbc7dd-4
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EDG-MED-971238d3-8
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EDJ-MED-f893e2a1-4
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DAR-DIA-ecdbc7dd-13
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MAT-POS-45b13633-3
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MAT-POS-e6dd326d-3
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EDJ-MED-f893e2a1-7
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EDJ-MED-f893e2a1-6
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ALP-UNI-0676e700-3
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EDJ-MED-28ec730d-2
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ALP-UNI-0676e700-2
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ALP-UNI-0676e700-28
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DAR-DIA-ecdbc7dd-11
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RAL-THA-e002e396-8
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RAL-THA-e002e396-2
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RAL-THA-e002e396-1
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RAL-THA-e002e396-11
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ALP-UNI-0676e700-29
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DAR-DIA-ecdbc7dd-3
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ALP-POS-477dc5b7-3
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MAT-POS-f9802937-6
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EDG-MED-971238d3-7
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MAT-POS-f9802937-5
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RAL-THA-e002e396-6
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MAT-POS-5d65ec79-2
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ALP-UNI-0676e700-13
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ALP-UNI-0676e700-21
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EDJ-MED-4c7486ba-8
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EDJ-MED-4c7486ba-11
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ALP-UNI-0676e700-7
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EDJ-MED-8c98ee63-2
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KAD-UNI-cb0f2bbc-22
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