Molecular Properties | |
SMILES: | Cc1ccc(CN2CCCN(C(=O)CCl)CC2)cc1 |
MW: | 280.13 |
Fraction sp3: | 0.53 |
HBA: | 2 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 23.55 |
cLogP: | 2.27 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✔️ |
Source | |
Enamine SCR: | Z2453117972 |
Enamine REAL: | Z1562121878 |
Mcule: | MCULE-1427988130 |
MolPort: | MolPort-016-636-111 |
TAT-ENA-80bfd3e5-20
0.571
AAR-POS-d2a4d1df-41
0.571
MAK-UNK-7c9d1431-29
0.554
DRR-IMP-38dce17f-7
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MAK-UNK-6ca90168-14
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MAK-UNK-7c9d1431-24
0.509
DRR-IMP-38dce17f-3
0.509
JIA-UNI-93b03cae-1
0.500
SAD-SAT-581007d4-2
0.500
AAR-POS-d2a4d1df-24
0.500
DRR-IMP-38dce17f-6
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PAU-UNI-8cdd41c7-1
0.467
SAD-SAT-581007d4-4
0.456
MAK-UNK-7c9d1431-20
0.453
AAR-POS-0daf6b7e-13
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MAK-UNK-212f693e-8
0.452
LON-WEI-8f408cad-7
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AHN-SAT-de2502ba-8
0.443
AAR-POS-d2a4d1df-25
0.443
SAD-SAT-5b1897b2-5
0.441
MAK-UNK-7c9d1431-14
0.441
MAR-TRE-6a44bbf2-12
0.439
MAR-LAB-ca4662a6-2
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DRR-IMP-38dce17f-4
0.438
AAR-POS-d2a4d1df-35
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MED-COV-4280ac29-15
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HYO-UNK-49a60884-1
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JOH-UNI-0e1753c1-3
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JOK-SYG-18591e8f-1
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DRR-IMP-38dce17f-2
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MAR-TRE-6a44bbf2-54
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MAT-POS-ee51dedd-1
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MAK-UNK-7c9d1431-16
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ANT-OPE-c0c3e7cc-1
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MAT-POS-2db6411e-2
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SAD-SAT-581007d4-1
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SAD-SAT-581007d4-7
0.409
DRR-IMP-38dce17f-1
0.406
SAD-SAT-5b1897b2-2
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AAR-POS-0daf6b7e-17
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AAR-POS-0daf6b7e-2
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SAD-SAT-65574d3f-10
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MAK-UNK-7c9d1431-28
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DRR-IMP-38dce17f-5
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LON-WEI-8f408cad-5
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STE-UNK-13e151dd-1
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TAT-ENA-80bfd3e5-30
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MED-COV-4280ac29-33
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SAD-SAT-581007d4-3
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MAR-TRE-6a44bbf2-68
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JOH-UNI-27ac80fd-23
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AAR-POS-0daf6b7e-12
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MAR-LAB-efb042c5-5
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AAR-POS-d2a4d1df-27
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SAD-SAT-bc31ec01-7
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MAK-UNK-af83ef51-1
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MAK-UNK-af83ef51-14
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TAM-UNI-d1c3dd9f-16
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NEH-REV-107bcf72-5
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SEL-UNI-cd366922-7
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WAR-XCH-bdd24732-25
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TAM-UNI-d1c3dd9f-6
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MAK-UNK-849bee6c-9
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TAM-UNI-d1c3dd9f-5
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SAD-SAT-bc31ec01-1
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BEN-DND-76ad4ac9-8
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PED-UNI-89deb5c9-1
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BEN-DND-6de5dfa0-16
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NIR-THE-b7e8e081-2
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STE-KUL-2e0d2e88-7
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MAK-UNK-4b073b5c-16
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AHN-SAT-de2502ba-15
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SEL-UNI-cd366922-6
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MAK-UNK-212f693e-7
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MAK-UNK-e4a48a85-18
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MAK-UNK-849bee6c-2
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AHN-SAT-de2502ba-14
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WIL-LEE-23e8b574-2
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SAD-SAT-65574d3f-1
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MAK-UNK-95198336-3
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MAK-UNK-176ca439-3
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MAK-UNK-cd94b63c-1
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TAM-UNI-d1c3dd9f-13
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ASH-SAT-43770c7d-5
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DAV-CRI-d1e0885a-1
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GIA-UNK-7337c2f3-7
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PAU-UNI-b2b6b158-1
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MAR-TRE-6a44bbf2-56
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MED-COV-4280ac29-25
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MED-COV-4280ac29-8
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SAD-SAT-d8079f6f-3
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SAD-SAT-d8079f6f-5
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ASH-SAT-43770c7d-10
0.358
MAK-UNK-e4a48a85-26
0.358
MAK-UNK-849bee6c-18
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SEL-UNI-cd366922-8
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MED-COV-4280ac29-31
0.356
AAR-POS-d2a4d1df-40
0.356
MAK-UNK-10dfa458-19
0.356