Molecular Properties | |
SMILES: | O=c1c2cc(F)c(Cl)cc2n(-c2ccccn2)c(=O)n1-c1cccnc1 |
MW: | 368.755 |
Fraction sp3: | 0.0 |
HBA: | 6 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 69.78 |
cLogP: | 2.7241 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
dyes5A(27)
LON-WEI-8f408cad-5
MAK-UNK-9e4a73aa-18
0.696
MAK-UNK-9e4a73aa-24
0.694
MAK-UNK-9e4a73aa-26
0.694
MAK-UNK-9e4a73aa-27
0.694
MAK-UNK-9e4a73aa-25
0.694
MAK-UNK-9e4a73aa-23
0.694
MAK-UNK-9e4a73aa-22
0.694
RAI-NOV-c18e0037-2
0.694
MAK-UNK-9e4a73aa-19
0.649
MAK-UNK-9e4a73aa-34
0.623
RAI-NOV-c18e0037-3
0.615
MAK-UNK-9e4a73aa-32
0.605
MAK-UNK-9e4a73aa-33
0.593
MAK-UNK-9e4a73aa-12
0.577
MAK-UNK-9e4a73aa-7
0.570
MAK-UNK-9e4a73aa-11
0.545
MAK-UNK-9e4a73aa-10
0.538
MAK-UNK-9e4a73aa-28
0.531
MAK-UNK-9e4a73aa-8
0.512
MAK-UNK-9e4a73aa-14
0.512
MAK-UNK-9e4a73aa-16
0.500
MAK-UNK-9e4a73aa-15
0.494
MAK-UNK-9e4a73aa-29
0.488
MAK-UNK-9e4a73aa-1
0.486
MAK-UNK-9e4a73aa-13
0.476
MAK-UNK-9e4a73aa-21
0.476
MAK-UNK-9e4a73aa-36
0.455
MAK-UNK-9e4a73aa-9
0.452
MAK-UNK-9e4a73aa-30
0.448
RAI-NOV-c18e0037-1
0.440
MAK-UNK-9e4a73aa-31
0.438
RAI-NOV-c18e0037-4
0.438
MAK-UNK-9e4a73aa-35
0.427
MAK-UNK-9e4a73aa-20
0.420
RAI-NOV-c18e0037-6
0.355
RAI-NOV-c18e0037-7
0.354
PET-UNK-94460c07-5
0.352
RAI-NOV-c18e0037-5
0.351
MAK-UNK-9e4a73aa-3
0.337
PET-UNK-94460c07-6
0.333
MAK-UNK-9e4a73aa-2
0.309
PET-UNK-4dc48bbe-5
0.303
NIM-UNI-0ea3b7bf-4
0.302
MAR-TRE-74c6519b-18
0.294
PET-UNK-4dc48bbe-3
0.287
MAR-TRE-74c6519b-26
0.279
STE-UNK-28609fce-1
0.279
NIM-UNI-7f77122c-1
0.278
DAR-DIA-fc970077-3
0.275
MAR-TRE-85681e92-8
0.271
MAK-UNK-9e4a73aa-5
0.271
NIM-UNI-0ea3b7bf-1
0.268
MAR-TRE-04c86cea-13
0.267
KEN-MCD-4729dc98-1
0.255
DAR-DIA-fc970077-1
0.253
PET-UNK-4dc48bbe-9
0.253
NIM-UNI-36e12f95-3
0.253
MAK-UNK-9e4a73aa-4
0.253
NEH-REV-83a5a839-1
0.252
MAK-UNK-9e4a73aa-6
0.250
NIM-UNI-0ea3b7bf-2
0.250
NIM-UNI-36e12f95-5
0.250
TAT-ENA-80bfd3e5-49
0.250
NIM-UNI-0ea3b7bf-3
0.250
MAR-TRE-b77b7921-32
0.248
MAR-TRE-b77b7921-49
0.248
NIM-UNI-534877e5-2
0.246
NIM-UNI-36e12f95-4
0.245
MAR-TRE-04c86cea-50
0.245
DAR-DIA-fc970077-6
0.244
DAR-DIA-fc970077-10
0.244
MAR-TRE-04c86cea-21
0.243
MAR-TRE-74c6519b-38
0.243
PET-UNK-4dc48bbe-7
0.242
MAR-TRE-b77b7921-43
0.241
JAN-GHE-83b26c96-18
0.239
DAR-DIA-fc970077-7
0.237
MAR-TRE-4b834d9a-35
0.236
DAR-DIA-fc970077-5
0.236
MAR-TRE-b77b7921-41
0.236
DAR-DIA-5d6f1b43-33
0.235
VLA-UNK-792b5d03-4
0.234
NIM-UNI-7f77122c-2
0.234
MAR-TRE-b77b7921-46
0.234
ZAC-MCD-b48cf8fd-1
0.233
MAR-TRE-d0525fbf-5
0.233
PET-UNK-4dc48bbe-2
0.232
MAR-TRE-04c86cea-52
0.231
MAR-TRE-3e4e6814-73
0.231
MAR-TRE-d0525fbf-49
0.231
NIM-UNI-534877e5-1
0.230
NIM-UNI-7f77122c-3
0.230
MAR-TRE-04c86cea-80
0.229
RAL-THA-9041a04d-1
0.228
WIL-UNI-1faa9b10-8
0.228
NIM-UNI-534877e5-3
0.228
VLA-UNK-792b5d03-2
0.227
MAR-TRE-b77b7921-33
0.226
MAR-TRE-74c6519b-83
0.226
MAR-TRE-74c6519b-2
0.226