Molecular Properties | |
SMILES: | CC(NC(=O)c1cccc(-n2nccc2C(F)(F)F)c1)c1c(F)cccc1F |
MW: | 395.11 |
Fraction sp3: | 0.16 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 46.92 |
cLogP: | 4.66 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2021-05-12 |
high halogen content (>3)
UNK-CYC-68f84b31-53
0.647
UNK-CYC-68f84b31-81
0.637
UNK-CYC-68f84b31-34
0.625
UNK-CYC-68f84b31-83
0.600
UNK-CYC-68f84b31-60
0.598
UNK-CYC-68f84b31-68
0.580
UNK-CYC-68f84b31-45
0.571
UNK-CYC-68f84b31-62
0.568
UNK-CYC-68f84b31-41
0.557
UNK-CYC-68f84b31-80
0.549
UNK-CYC-68f84b31-74
0.533
UNK-CYC-68f84b31-64
0.529
UNK-CYC-68f84b31-90
0.527
UNK-CYC-68f84b31-4
0.524
UNK-CYC-68f84b31-78
0.516
UNK-CYC-68f84b31-31
0.500
UNK-CYC-68f84b31-70
0.478
UNK-CYC-68f84b31-51
0.433
UNK-CYC-68f84b31-14
0.432
UNK-CYC-68f84b31-19
0.430
UNK-CYC-68f84b31-73
0.427
UNK-CYC-68f84b31-15
0.418
UNK-CYC-68f84b31-43
0.417
UNK-CYC-68f84b31-32
0.404
UNK-CYC-68f84b31-46
0.404
UNK-CYC-68f84b31-24
0.393
UNK-CYC-68f84b31-13
0.359
UNK-CYC-68f84b31-79
0.357
UNK-CYC-68f84b31-9
0.349
UNK-CYC-68f84b31-26
0.340
UNK-CYC-68f84b31-58
0.340
UNK-CYC-68f84b31-48
0.337
UNK-CYC-68f84b31-17
0.330
UNK-CYC-68f84b31-30
0.327
UNK-CYC-68f84b31-10
0.321
UNK-CYC-68f84b31-3
0.321
UNK-CYC-68f84b31-6
0.315
UNK-CYC-68f84b31-54
0.313
UNK-CYC-68f84b31-71
0.299
UNK-CYC-68f84b31-59
0.298
UNK-CYC-68f84b31-44
0.295
UNK-CYC-68f84b31-8
0.295
UNK-CYC-68f84b31-55
0.292
UNK-CYC-68f84b31-39
0.287
UNK-CYC-68f84b31-29
0.277
BEN-VAN-5787f7d3-5
0.275
MAR-TRE-66ac689e-45
0.268
UNK-CYC-68f84b31-61
0.267
MAR-TRE-799db12b-45
0.265
MAR-TRE-799db12b-49
0.265
UNK-CYC-68f84b31-52
0.259
MAR-TRE-66ac689e-77
0.253
BAR-COM-4e090d3a-2
0.248
UNK-CYC-68f84b31-12
0.245
MAR-TRE-8190bb11-36
0.245
UNK-CYC-68f84b31-11
0.243
MAR-TRE-799db12b-36
0.243
WIL-UNI-1faa9b10-46
0.242
TAT-ENA-80bfd3e5-48
0.241
UNK-CYC-68f84b31-47
0.239
UNK-CYC-68f84b31-38
0.236
AAR-UNI-c25c2f1e-94
0.235
UNK-CYC-68f84b31-49
0.235
AAR-UNI-c25c2f1e-103
0.234
MAR-TRE-799db12b-75
0.228
MAR-TRE-66ac689e-36
0.225
MAR-TRE-9d18ae8c-62
0.225
UNK-CYC-68f84b31-40
0.225
MAR-TRE-799db12b-73
0.224
MAR-TRE-a9136c7b-13
0.224
UNK-CYC-68f84b31-84
0.224
UNK-CYC-68f84b31-27
0.223
MAR-TRE-be9ff7d2-47
0.222
UNK-CYC-68f84b31-28
0.221
MAR-TRE-9d18ae8c-80
0.220
MAR-TRE-8190bb11-98
0.219
MAK-UNK-1e8f9e3c-1
0.217
MAK-UNK-9159f8ed-6
0.217
AAR-UNI-c25c2f1e-89
0.217
MAR-TRE-66ac689e-72
0.216
WIL-UNI-d4749f31-45
0.216
MAR-TRE-a9136c7b-8
0.215
AAR-UNI-c25c2f1e-19
0.214
BEN-VAN-5787f7d3-8
0.214
MAT-POS-a3f7f96a-4
0.214
MAR-TRE-a9136c7b-35
0.214
MAR-TRE-66ac689e-22
0.212
MAR-TRE-66ac689e-27
0.212
DAR-DIA-0cde14eb-76
0.212
JAN-GHE-83b26c96-14
0.212
ALP-POS-95b75b4d-3
0.212
JON-UIO-066ce08b-14
0.212
MAR-TRE-9d18ae8c-9
0.212
WIL-UNI-1faa9b10-7
0.212
WIL-UNI-1faa9b10-18
0.211
JON-UIO-066ce08b-7
0.211
MAR-LAB-ff9967db-18
0.211
MAR-TRE-66ac689e-66
0.210
AUS-ARG-7cfdce8f-12
0.209
MAR-TRE-04c86cea-54
0.208