Molecular Properties | |
SMILES: | CCS(=O)(=O)CC(C)NC(=O)c1cccc(-n2nccc2C(F)(F)F)c1 |
MW: | 389.1 |
Fraction sp3: | 0.38 |
HBA: | 5 |
HBD: | 1 |
Rotatable Bonds: | 6 |
TPSA: | 81.06 |
cLogP: | 2.44 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2021-05-12 |
Long aliphatic chain
UNK-CYC-68f84b31-81
0.701
UNK-CYC-68f84b31-65
0.625
UNK-CYC-68f84b31-60
0.617
UNK-CYC-68f84b31-45
0.610
UNK-CYC-68f84b31-62
0.605
UNK-CYC-68f84b31-83
0.600
UNK-CYC-68f84b31-68
0.580
UNK-CYC-68f84b31-41
0.575
UNK-CYC-68f84b31-80
0.567
UNK-CYC-68f84b31-26
0.566
UNK-CYC-68f84b31-78
0.548
UNK-CYC-68f84b31-74
0.533
UNK-CYC-68f84b31-64
0.529
UNK-CYC-68f84b31-4
0.524
UNK-CYC-68f84b31-53
0.522
UNK-CYC-68f84b31-31
0.517
UNK-CYC-68f84b31-90
0.495
UNK-CYC-68f84b31-70
0.495
UNK-CYC-68f84b31-73
0.455
UNK-CYC-68f84b31-19
0.446
UNK-CYC-68f84b31-32
0.435
UNK-CYC-68f84b31-43
0.432
UNK-CYC-68f84b31-51
0.406
UNK-CYC-68f84b31-46
0.404
UNK-CYC-68f84b31-15
0.387
UNK-CYC-68f84b31-24
0.380
UNK-CYC-68f84b31-79
0.357
UNK-CYC-68f84b31-17
0.343
UNK-CYC-68f84b31-6
0.340
UNK-CYC-68f84b31-13
0.333
UNK-CYC-68f84b31-58
0.327
UNK-CYC-68f84b31-3
0.321
UNK-CYC-68f84b31-14
0.320
UNK-CYC-68f84b31-12
0.320
UNK-CYC-68f84b31-55
0.314
UNK-CYC-68f84b31-54
0.313
UNK-CYC-68f84b31-9
0.312
UNK-CYC-68f84b31-48
0.311
UNK-CYC-68f84b31-10
0.309
UNK-CYC-68f84b31-30
0.304
UNK-CYC-68f84b31-59
0.286
UNK-CYC-68f84b31-8
0.283
UNK-CYC-68f84b31-61
0.279
UNK-CYC-68f84b31-71
0.275
UNK-CYC-68f84b31-39
0.275
UNK-CYC-68f84b31-29
0.265
UNK-CYC-68f84b31-44
0.259
UNK-CYC-68f84b31-52
0.259
AAR-UNI-c25c2f1e-103
0.257
BEN-VAN-5787f7d3-5
0.252
UNK-CYC-68f84b31-47
0.250
UNK-CYC-68f84b31-40
0.248
MAR-TRE-9d18ae8c-80
0.245
UNK-CYC-68f84b31-11
0.243
MAR-TRE-66ac689e-45
0.242
TAT-ENA-80bfd3e5-48
0.241
MAR-TRE-799db12b-45
0.240
MAR-TRE-799db12b-49
0.240
MAK-UNK-9159f8ed-6
0.240
MAK-UNK-1e8f9e3c-1
0.240
MAR-TRE-799db12b-63
0.240
BAR-COM-4e090d3a-2
0.237
MAR-TRE-799db12b-73
0.237
UNK-CYC-68f84b31-49
0.235
JAG-UCB-a3ef7265-21
0.235
UNK-CYC-68f84b31-27
0.233
AAR-UNI-c25c2f1e-89
0.232
UNK-CYC-68f84b31-28
0.231
MAR-TRE-799db12b-36
0.231
UNK-CYC-68f84b31-38
0.224
MAT-POS-a3f7f96a-4
0.224
WIL-UNI-1faa9b10-7
0.223
MAR-TRE-9d18ae8c-1
0.223
MAR-TRE-be9ff7d2-47
0.222
MAK-UNK-1e8f9e3c-2
0.222
ALP-POS-88a7a97e-2
0.221
MAR-LAB-ff9967db-18
0.221
MAR-TRE-4f781e27-29
0.221
MAR-TRE-8190bb11-36
0.219
MAT-POS-bfefc3ea-4
0.217
MAT-POS-b5746674-22
0.216
UNK-CYC-68f84b31-7
0.216
MAK-UNK-9159f8ed-5
0.216
ALP-POS-ced8ea4d-37
0.216
MAR-TRE-799db12b-75
0.216
INS-INS-7e24ab41-1
0.215
MAT-POS-162a9720-2
0.215
NIL-NON-a189c016-1
0.215
MAR-TRE-92684b97-66
0.215
AAR-UNI-c25c2f1e-19
0.214
ARI-TAT-5792557e-28
0.214
MAR-TRE-a9136c7b-13
0.213
MAK-UNK-9159f8ed-7
0.213
MAR-TRE-7f7bb9f0-57
0.213
MAK-UNK-7a704a63-9
0.213
MAR-TRE-66ac689e-27
0.212
MAR-TRE-66ac689e-22
0.212
MAR-TRE-3e4e6814-1
0.212
AAR-UNI-c25c2f1e-94
0.212
LON-WEI-adc59df6-31
0.211