Molecular Properties | |
SMILES: | Cc1c(F)cccc1NC(=O)NCCNc1cc(N2CCOCC2)ncn1 |
MW: | 374.19 |
Fraction sp3: | 0.39 |
HBA: | 6 |
HBD: | 3 |
Rotatable Bonds: | 6 |
TPSA: | 91.41 |
cLogP: | 1.99 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-7223453857 |
MolPort: | MolPort-020-183-222 |
Aliphatic long chain
MAR-TRE-f5c2d31c-54
0.685
MAR-TRE-f5c2d31c-74
0.670
MAR-TRE-f5c2d31c-52
0.652
MAR-TRE-f5c2d31c-70
0.637
MAR-TRE-fd17a9b8-49
0.637
MAR-TRE-f5c2d31c-35
0.630
MAR-TRE-f5c2d31c-20
0.626
MAR-TRE-f5c2d31c-18
0.626
MAR-TRE-f5c2d31c-96
0.625
MAR-TRE-f5c2d31c-38
0.618
MAR-TRE-f5c2d31c-63
0.606
MAR-TRE-f5c2d31c-83
0.606
MAR-TRE-f5c2d31c-99
0.604
MAR-TRE-f5c2d31c-81
0.600
MAR-TRE-f5c2d31c-13
0.596
MAR-TRE-f5c2d31c-36
0.591
MAR-TRE-f5c2d31c-42
0.591
MAR-TRE-fd17a9b8-85
0.521
MAR-TRE-f5c2d31c-27
0.470
MAR-TRE-f5c2d31c-57
0.450
MAR-TRE-f5c2d31c-66
0.441
MAR-TRE-f5c2d31c-29
0.431
MAR-TRE-f5c2d31c-28
0.413
MAR-TRE-f5c2d31c-22
0.413
MAR-TRE-f5c2d31c-33
0.411
MAR-TRE-f5c2d31c-9
0.404
MAR-TRE-f5c2d31c-7
0.402
MAR-TRE-f5c2d31c-39
0.402
MAR-TRE-f5c2d31c-11
0.400
MAR-TRE-f5c2d31c-19
0.385
MAR-TRE-f5c2d31c-37
0.382
MAR-TRE-3159af1a-55
0.375
MAR-TRE-dab8f6ea-48
0.356
MAR-TRE-fd17a9b8-72
0.336
MAR-TRE-f5c2d31c-43
0.336
MAR-TRE-f5c2d31c-8
0.324
MAR-TRE-f5c2d31c-24
0.321
MAR-TRE-f5c2d31c-12
0.303
MAR-TRE-6a44bbf2-67
0.302
MAR-TRE-0fda4e82-90
0.302
MAR-TRE-f5c2d31c-25
0.296
MAR-TRE-3159af1a-82
0.293
MAR-TRE-9c797165-83
0.290
MAR-TRE-f5c2d31c-34
0.290
MAR-TRE-67513f76-86
0.283
BAR-COM-0f94fc3d-33
0.279
MAR-TRE-9c797165-58
0.269
MAR-TRE-3159af1a-52
0.269
LON-WEI-d1c9908a-9
0.264
MAR-TRE-3159af1a-17
0.264
ALP-POS-d0876c20-6
0.262
WIL-NOV-649f4ed0-2
0.262
WIL-NOV-649f4ed0-5
0.262
ALP-POS-a3de0cb1-12
0.260
JOH-UNI-522b0723-10
0.257
BAR-COM-4e090d3a-58
0.255
MAR-TRE-9c797165-32
0.255
MAR-TRE-3159af1a-71
0.254
MAR-TRE-3159af1a-95
0.254
LON-WEI-b8d98729-36
0.254
ALP-POS-d0876c20-12
0.254
ANT-DIA-b7f58f21-9
0.252
MAR-TRE-3159af1a-15
0.252
MAR-LAB-ca4662a6-5
0.250
AHN-SAT-de2502ba-13
0.250
MAR-TRE-6a44bbf2-83
0.250
MAR-TRE-3159af1a-88
0.248
MAR-TRE-4b834d9a-64
0.248
MAR-TRE-9c797165-69
0.248
LON-WEI-d1c9908a-13
0.246
ALP-POS-bad7201a-8
0.246
NIM-UNI-310206f0-7
0.245
PET-SGC-cb83a00c-1
0.245
MAR-TRE-dab8f6ea-39
0.243
MAR-TRE-c317dd82-22
0.241
MAR-TRE-3159af1a-28
0.241
AHN-SAT-de2502ba-9
0.240
AHN-SAT-de2502ba-4
0.240
MAR-TRE-6a44bbf2-100
0.240
MAT-POS-b5746674-109
0.239
LON-WEI-4d77710c-16
0.239
MAT-POS-2492181e-11
0.239
LON-WEI-5e7d1b3e-16
0.239
SAD-SAT-7d5528d9-1
0.239
MAR-TRE-67513f76-60
0.239
MAR-TRE-a9136c7b-28
0.238
ALP-POS-95f71980-19
0.238
PET-SGC-276eba5a-1
0.238
BEN-DND-93268d01-10
0.238
PET-SGC-6016d8e6-1
0.237
BOG-INS-bdba9cfb-1
0.236
MAR-TRE-8190bb11-100
0.234
WIL-NOV-649f4ed0-1
0.234
KAD-UNI-cb0f2bbc-17
0.233
MAT-POS-61f37a1a-8
0.233
JOH-UNI-abdb2f0c-3
0.233
MAR-TRE-c8530538-38
0.232
MAR-TRE-dab8f6ea-13
0.232
MAR-TRE-6a44bbf2-42
0.231
DRA-CSI-7ec17797-5
0.231