Molecular Properties | |
SMILES: | COC(=O)[C@H]1CC[C@@H](CNC(C(=O)Nc2cncc3ccccc23)c2cccc(Cl)c2)O1 |
MW: | 453.15 |
Fraction sp3: | 0.29 |
HBA: | 6 |
HBD: | 2 |
Rotatable Bonds: | 7 |
TPSA: | 89.55 |
cLogP: | 3.88 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 1.71512725254952 |
Order Status | |
Shipped: | 2021-05-26 |
Ester
EDJ-MED-cf4b0d25-2
0.755
EDJ-MED-cf4b0d25-4
0.583
PET-UNK-1320d94d-1
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PET-UNK-1320d94d-2
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EDJ-MED-ee07cf00-4
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PET-UNK-1320d94d-5
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PET-UNK-1320d94d-6
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EDJ-MED-cf4b0d25-5
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EDJ-MED-ee07cf00-11
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MAT-POS-a13804f0-4
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PET-UNK-ac320b15-5
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PET-UNK-ac320b15-6
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PET-UNK-ac320b15-8
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PET-UNK-ac320b15-9
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MAT-POS-8293a91a-6
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MAT-POS-8293a91a-7
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MAT-POS-7174c657-6
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PET-UNK-ac320b15-7
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MAT-POS-8293a91a-2
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MAT-POS-1f3f1a6f-4
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EDJ-MED-ee07cf00-6
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PET-UNK-1320d94d-8
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PET-UNK-1320d94d-7
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VLA-UNK-9a7dc93f-7
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PET-UNK-1320d94d-3
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PET-UNK-1320d94d-4
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PET-UNK-1320d94d-9
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PET-UNK-1320d94d-10
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EDJ-MED-ee07cf00-18
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EDJ-MED-cf4b0d25-1
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EDJ-MED-ee07cf00-12
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PET-UNK-1320d94d-21
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PET-UNK-1320d94d-22
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EDJ-MED-ee07cf00-13
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MAT-POS-a13804f0-1
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EDJ-MED-ee07cf00-10
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EDJ-MED-ee07cf00-1
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EDJ-MED-ee07cf00-16
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MAK-UNK-ffc90da7-7
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MIC-UNK-5a93dd5f-2
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EDJ-MED-ee07cf00-7
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MAK-UNK-ffc90da7-4
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MIC-UNK-c66144cb-3
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ALP-POS-3b848b35-4
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MIC-UNK-5a93dd5f-8
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EDJ-MED-ee07cf00-8
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EDJ-MED-ee07cf00-17
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EDJ-MED-ee07cf00-5
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NIR-THE-590dedc7-1
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MIC-UNK-5a93dd5f-10
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NAU-LAT-a5c7d7cb-2
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MIC-UNK-6ab519a7-1
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EDJ-MED-ee07cf00-15
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MIC-UNK-5a93dd5f-1
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EDJ-MED-ee07cf00-9
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JOH-UNI-3fc3434e-6
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JOH-UNI-ee5ed7c8-6
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MIC-UNK-5a93dd5f-5
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MIC-UNK-5a93dd5f-9
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MIC-UNK-5a93dd5f-6
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EDJ-MED-ee07cf00-14
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PET-UNK-1320d94d-25
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PET-UNK-1320d94d-26
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MIC-UNK-5a93dd5f-3
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MAK-UNK-ffc90da7-1
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MAK-UNK-c749d764-6
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MAT-POS-fce787c2-10
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ALP-POS-a9ad2217-2
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PET-UNK-10339a1d-1
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PET-UNK-1320d94d-27
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PET-UNK-1320d94d-28
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EDJ-MED-ee07cf00-2
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EDJ-MED-ee07cf00-3
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MIC-UNK-d36ab305-1
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MIC-UNK-5a93dd5f-7
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PET-UNK-1320d94d-23
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PET-UNK-1320d94d-24
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MIC-UNK-c66144cb-1
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MIC-UNK-d36ab305-4
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MIC-UNK-5a93dd5f-11
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MIC-UNK-5a93dd5f-12
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MIC-UNK-c66144cb-2
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PET-UNK-1320d94d-11
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PET-UNK-1320d94d-12
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MAT-POS-fce787c2-5
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PET-UNK-1320d94d-29
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PET-UNK-1320d94d-30
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ADA-UCB-6c2cb422-1
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DAR-DIA-0cde14eb-56
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MAT-POS-1f3f1a6f-3
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ALP-POS-f13221e1-2
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MAT-POS-fce787c2-3
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ALP-POS-ddb41b15-6
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MIC-UNK-bcd487e9-4
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DAR-DIA-0cde14eb-55
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