Molecular Properties | |
SMILES: | Cc1cc(CN(C)C(=O)C2CCOc3ccc(Cl)cc32)on1 |
MW: | None |
Fraction sp3: | None |
HBA: | None |
HBD: | None |
Rotatable Bonds: | None |
TPSA: | None |
cLogP: | None |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
VLA-UCB-1dbca3b4-15
DAR-DIA-6a508060-14
0.675
LON-WEI-0a73fcb8-5
0.512
DAR-DIA-6a508060-16
0.500
ERI-UCB-9c7ec71b-3
0.477
LON-WEI-0a73fcb8-1
0.472
LON-WEI-0a73fcb8-2
0.467
TAT-ENA-0e28ea53-1
0.456
ALP-POS-8b8a49e1-3
0.447
JAG-UCB-c61058a9-41
0.444
PET-UNK-158bee2a-7
0.443
WIL-UCB-7ba4ac3a-2
0.442
MAK-UNK-3875bbc8-2
0.442
MIC-UNK-42806bd5-4
0.442
MAT-POS-7ddaf7de-4
0.440
NAU-LAT-8502cac5-10
0.438
RAL-THA-3d7a794f-4
0.438
RAL-THA-b74298ba-1
0.438
MAT-POS-afb6844f-3
0.436
NAU-LAT-b7d8c353-1
0.435
MAT-POS-a3f7f96a-2
0.433
MIC-UNK-4c7b8ba7-2
0.433
ADA-UCB-dc2b944c-10
0.433
ALP-POS-6495d03e-1
0.432
MAT-POS-afb6844f-2
0.430
JAG-UCB-c61058a9-2
0.430
JAN-GHE-f4ca5a00-13
0.429
BRU-CON-c4e3408a-1
0.429
MAT-POS-b3e365b9-3
0.429
MAT-POS-b3e365b9-4
0.429
NAU-LAT-b7d8c353-7
0.429
NAU-LAT-8502cac5-16
0.429
DAR-DIA-6a508060-6
0.429
MIC-UNK-13557a72-2
0.427
MAT-POS-a2421bb6-4
0.426
VLA-UNK-0ffe3317-1
0.426
ROB-UNI-569bc02e-4
0.424
MAT-POS-8293a91a-1
0.424
MAT-POS-afb6844f-1
0.424
MAT-POS-b5c94171-1
0.424
MAT-POS-1f3c8e6f-1
0.419
MAK-UNK-919546f0-1
0.419
MAK-UNK-f481d203-1
0.419
MAK-UNK-f481d203-2
0.419
JAG-UCB-c61058a9-44
0.419
PET-UNK-e274cad4-2
0.418
VLA-UCB-05e51b3f-4
0.418
VLA-UCB-50c39ae8-1
0.418
MAT-POS-51833a24-2
0.418
PAU-WIS-d4065696-2
0.418
JAG-UCB-c61058a9-6
0.418
ALP-POS-8b8a49e1-4
0.418
NAU-LAT-8502cac5-13
0.417
ADA-UCB-dc2b944c-12
0.417
JOH-SUS-a69c159d-1
0.417
MAT-POS-ee5e8e94-1
0.416
MIC-UNK-42806bd5-3
0.416
ALP-POS-8b8a49e1-1
0.416
MIC-UNK-fc94cdb5-2
0.416
ROB-UNI-569bc02e-3
0.415
RAL-THA-3d7a794f-3
0.415
MAT-POS-500f4700-1
0.415
RAL-THA-b74298ba-2
0.415
RAL-THA-b74298ba-3
0.413
JAG-UCB-c61058a9-21
0.413
EDG-MED-fe7487f8-9
0.413
VLA-UCB-53bdeed6-2
0.413
LON-WEI-0a73fcb8-4
0.412
PAU-WIS-d4065696-1
0.412
JAG-UCB-52b62a6f-10
0.410
JAG-UCB-52b62a6f-14
0.410
JOH-UNI-1b27fa5e-7
0.409
JAG-UCB-c61058a9-7
0.409
JAG-UCB-c61058a9-9
0.409
MAT-POS-51833a24-5
0.408
ALF-EVA-5b152d2f-2
0.408
VLA-UNK-4b5c0188-1
0.408
DAR-DIA-5ff57136-19
0.407
ROB-UNI-569bc02e-6
0.406
RAL-THA-b74298ba-4
0.406
PET-UNK-b1ef24dc-5
0.406
PET-UNK-b1ef24dc-7
0.406
VLA-UCB-50c39ae8-6
0.406
VLA-UCB-05e51b3f-9
0.406
VLA-UNK-0ffe3317-2
0.404
LON-WEI-0a73fcb8-6
0.404
LON-WEI-0a73fcb8-7
0.404
DAR-DIA-6a508060-7
0.404
JOH-UNI-d0d90dc1-3
0.404
BEN-DND-a7517465-1
0.404
EDJ-MED-51d3200d-2
0.404
JOH-UNI-16fcdf60-1
0.402
ROB-UNI-569bc02e-5
0.402
ALP-POS-ce760d3f-3
0.402
JOH-UNI-1b27fa5e-5
0.402
BEN-DND-4f474d93-2
0.402
PET-UNK-f4e47ebd-4
0.402
ALP-UNI-44c99a80-3
0.402
MAT-POS-14f31916-4
0.400
VLA-UCB-34f3ed0c-1
0.400
RAL-THA-3d7a794f-2
0.400