Molecular Properties | |
SMILES: | CC(=O)N1CCN(CC(=O)Nc2cnccc2C)CC1 |
MW: | 276.16 |
Fraction sp3: | 0.5 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 65.54 |
cLogP: | 0.49 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule Ultimate: | YHXAYSKGSZLMHI-UHFFFAOYSA-N |
Activity Data | |
IC50 (µM) - Fluorescence: | 0.637897638524396 |
IC50 (µM) - RapidFire: | 99.0 |
Order Status | |
Ordered: | 2020-12-14 |
Synthesis Location: | mcule |
Shipped: | 2020-08-12 |
AAR-POS-d2a4d1df-1
ALP-POS-6747fa38-1
NIR-THE-d08c3b48-1
MIC-UNK-6ab519a7-1
MIC-UNK-9582b2c5-3
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EDJ-MED-3c65e9ce-4
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EDJ-MED-3c65e9ce-2
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BEN-DND-6de5dfa0-21
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BEN-DND-09b88bf4-7
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MAK-UNK-6ca90168-26
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BEN-DND-22e6b372-4
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NAU-LAT-a5c7d7cb-1
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VLA-UCB-05e51b3f-1
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MAT-POS-590ac91e-6
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AAR-POS-d2a4d1df-3
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MAK-UNK-6435e6c2-8
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ALE-HEI-f28a35b5-12
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EDJ-MED-c9f55a56-1
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MAT-POS-590ac91e-11
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MAK-UNK-902cc841-17
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MAT-POS-590ac91e-9
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PET-SGC-fedd1f79-1
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MAT-POS-590ac91e-10
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NAU-LAT-3f5f3993-10
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PET-SGC-6e7c5dc0-1
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NAU-LAT-a5c7d7cb-3
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VLA-UCB-05e51b3f-2
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ANN-UNI-98d2bf15-1
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MAT-POS-590ac91e-15
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JOH-UNI-abfda500-6
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MAT-POS-590ac91e-17
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MAT-POS-590ac91e-5
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BAR-COM-0f94fc3d-41
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ALP-POS-95b75b4d-2
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BAR-COM-0f94fc3d-18
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ALE-HEI-f28a35b5-3
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MIH-UNI-6b9ca91a-1
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ALP-POS-95b75b4d-4
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ERI-UCB-5b47150d-4
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SAM-UNK-2684b532-9
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MAK-UNK-372b0df5-3
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JAN-GHE-83b26c96-12
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