Molecular Properties | |
SMILES: | O=C(Cc1cncc2ccccc12)N(CCC1CCCCC1)c1cccc(Cl)c1 |
MW: | 406.18 |
Fraction sp3: | 0.36 |
HBA: | 2 |
HBD: | 0 |
Rotatable Bonds: | 6 |
TPSA: | 33.2 |
cLogP: | 6.43 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
MolPort: | MolPort-047-570-345 |
Activity Data | |
IC50 (µM) - Fluorescence: | 2.11245923161491 |
IC50 (µM) - RapidFire: | 1.02108749221712 |
Order Status | |
Shipped: | 2020-10-06 |
EDJ-MED-c314995a-1
0.598
VLA-UCB-05e51b3f-14
0.598
NAU-LAT-a5c7d7cb-4
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MIC-UNK-cdc2493e-1
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ALP-POS-64a710fa-1
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MIC-UNK-bcd487e9-2
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MIC-UNK-d36ab305-6
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ALP-POS-75715966-2
0.505
MAK-UNK-b7886382-3
0.500
MIC-UNK-d36ab305-3
0.490
MIC-UNK-c66144cb-6
0.485
MIC-UNK-bcd487e9-3
0.485
VLA-UCB-34f3ed0c-2
0.475
MAT-POS-6c284e65-2
0.471
ALP-POS-c3a96089-4
0.471
MAT-POS-6c284e65-1
0.471
DAR-DIA-6a49afbe-4
0.470
ALP-POS-b3306dea-1
0.465
VLA-UCB-34f3ed0c-6
0.461
DAR-DIA-6a49afbe-1
0.461
MAT-POS-136e7878-1
0.459
JOR-UNI-2fc98d0b-12
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ADA-UCB-dc2b944c-3
0.452
ADA-UCB-dc2b944c-17
0.452
DAR-DIA-6a49afbe-5
0.443
MIC-UNK-cdc2493e-15
0.442
MAT-UCB-93f6aed8-2
0.442
MIC-UNK-c66144cb-3
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ALP-POS-3b848b35-4
0.442
PET-UNK-8922bd3c-1
0.440
ALP-POS-c3a96089-3
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PET-UNK-a17c93d1-1
0.438
MIC-UNK-bcd487e9-4
0.437
MIC-UNK-bcd487e9-6
0.437
ADA-UCB-dc2b944c-2
0.435
ALP-POS-c3a96089-1
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ALP-POS-25b4df59-2
0.434
ALP-POS-25b4df59-1
0.434
MIC-UNK-cdc2493e-2
0.429
ALP-POS-7c6e02c7-3
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MAK-UNK-b7886382-4
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JUL-TUD-06b2044f-53
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ALP-POS-7c6e02c7-1
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NAU-LAT-a5c7d7cb-8
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DAR-DIA-6a49afbe-3
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DAR-DIA-6a49afbe-8
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MAT-POS-53907a1c-3
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MAK-UNK-b7886382-5
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MIC-UNK-cdc2493e-5
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DAR-DIA-6a49afbe-2
0.402
PET-UNK-1901c25b-1
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DAR-DIA-6a49afbe-7
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ALP-POS-c3a96089-2
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MIC-UNK-cdc2493e-19
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DAR-DIA-6a508060-1
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MIC-UNK-cdc2493e-17
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DAR-DIA-6a49afbe-6
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ADA-UCB-dc2b944c-6
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MIC-UNK-cdc2493e-4
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JOH-UNI-ea1df7a8-1
0.388
DAR-DIA-6a49afbe-9
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MIC-UNK-cdc2493e-24
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PET-UNK-55f647aa-2
0.387
JOR-UNI-2fc98d0b-8
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MIC-UNK-cdc2493e-3
0.385
MIC-UNK-cdc2493e-23
0.385
ALF-EVA-650655fc-3
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MIC-UNK-cdc2493e-18
0.383
PET-UNK-55f647aa-1
0.383
MIC-UNK-bcd487e9-1
0.382
NAU-LAT-4ce8bf23-2
0.382
VLA-UCB-34f3ed0c-13
0.380
MIC-UNK-cdc2493e-8
0.378
MIC-UNK-cdc2493e-13
0.378
MIC-UNK-bcd487e9-10
0.377
JOH-UNI-a38a7bdd-2
0.376
MIC-UNK-cdc2493e-22
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MIC-UNK-cdc2493e-6
0.375
DAR-DIA-6a49afbe-10
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MIC-UNK-cdc2493e-16
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ADA-UCB-dc2b944c-18
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ALP-POS-64a710fa-2
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NAU-LAT-2fed8305-8
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MIC-UNK-cdc2493e-14
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MIC-UNK-cdc2493e-11
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MIC-UNK-bcd487e9-5
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ERI-UCB-d6de1f3c-5
0.371
DAR-DIA-6a49afbe-12
0.369
MAK-UNK-b7886382-2
0.368
DAR-DIA-6a49afbe-11
0.368
ALF-EVA-650655fc-2
0.368
VLA-UCB-1dbca3b4-12
0.366
MIC-UNK-a28eba03-4
0.366
ALP-POS-7c6e02c7-2
0.365
MIC-UNK-a28eba03-3
0.365
MIC-UNK-5a93dd5f-2
0.364
MIC-UNK-cdc2493e-12
0.364
ERI-UCB-ce40166b-5
0.364
PET-UNK-12d8d43f-1
0.364
DAR-DIA-53551c05-12
0.362