Molecular Properties | |
SMILES: | O=C1c2cc(F)c(Cl)cc2N(c2ccccc2)C(=O)C1c1cccnc1 |
MW: | 366.779 |
Fraction sp3: | 0.05 |
HBA: | 3 |
HBD: | 0 |
Rotatable Bonds: | 2 |
TPSA: | 50.27 |
cLogP: | 4.5189 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
beta-keto/anhydride
Ketone
Dye 11
LON-WEI-8f408cad-5
MAK-UNK-9e4a73aa-4
0.761
MAK-UNK-9e4a73aa-5
0.476
MAK-UNK-9e4a73aa-3
0.448
RAI-NOV-c18e0037-6
0.420
MAK-UNK-9e4a73aa-6
0.417
MAK-UNK-9e4a73aa-24
0.360
MAK-UNK-9e4a73aa-26
0.360
MAK-UNK-9e4a73aa-27
0.360
MAK-UNK-9e4a73aa-25
0.360
MAK-UNK-9e4a73aa-23
0.360
MAK-UNK-9e4a73aa-22
0.360
RAI-NOV-c18e0037-2
0.360
JAN-GHE-83b26c96-18
0.345
MAK-UNK-9e4a73aa-12
0.341
MAK-UNK-9e4a73aa-8
0.337
MAK-UNK-9e4a73aa-7
0.337
RAI-NOV-c18e0037-5
0.326
MAK-UNK-9e4a73aa-14
0.323
MAK-UNK-9e4a73aa-18
0.318
DAR-DIA-fc970077-4
0.314
MAK-UNK-9e4a73aa-35
0.312
MAK-UNK-9e4a73aa-31
0.309
MAK-UNK-9e4a73aa-17
0.309
MAK-UNK-9e4a73aa-21
0.309
DAR-DIA-fc970077-2
0.306
MAK-UNK-9e4a73aa-20
0.305
MAK-UNK-9e4a73aa-15
0.304
MAK-UNK-9e4a73aa-32
0.303
MAK-UNK-9e4a73aa-19
0.301
MAK-UNK-9e4a73aa-9
0.301
PET-UNK-4dc48bbe-9
0.299
MAR-TRE-74c6519b-18
0.298
MAR-TRE-74c6519b-26
0.298
MAK-UNK-9e4a73aa-13
0.295
MAK-UNK-9e4a73aa-28
0.295
MAK-UNK-9e4a73aa-34
0.292
RAI-NOV-c18e0037-3
0.289
MAK-UNK-9e4a73aa-30
0.289
PET-UNK-4dc48bbe-7
0.286
ERI-UCB-ce40166b-24
0.284
MAK-UNK-9e4a73aa-16
0.284
DAR-DIA-fc970077-12
0.284
MAK-UNK-9e4a73aa-36
0.283
MAK-UNK-9e4a73aa-11
0.283
MAK-UNK-9e4a73aa-1
0.282
MAK-UNK-9e4a73aa-33
0.280
MAK-UNK-9e4a73aa-10
0.280
MAK-UNK-9e4a73aa-29
0.278
PET-UNK-7a31b064-5
0.268
DAR-DIA-fc970077-8
0.267
DAR-DIA-fc970077-7
0.267
RAI-NOV-c18e0037-4
0.267
PET-UNK-4dc48bbe-1
0.263
RAI-NOV-c18e0037-1
0.263
PET-UNK-7a31b064-6
0.263
DAR-DIA-fc970077-3
0.263
MIC-UNK-df342a3f-1
0.257
ZAC-MCD-b48cf8fd-1
0.256
DAR-DIA-fc970077-1
0.256
MAR-TRE-04c86cea-13
0.256
RAI-NOV-c18e0037-7
0.250
DAR-DIA-fc970077-6
0.247
DAR-DIA-fc970077-10
0.247
VLA-UNK-792b5d03-4
0.246
KEN-MCD-4729dc98-1
0.245
DAR-DIA-fc970077-11
0.242
BEN-DND-031a96cc-3
0.240
DUN-NEW-d8381160-1
0.240
CHR-SOS-7098f804-13
0.240
NIM-UNI-0ea3b7bf-5
0.239
JUL-TUD-06b2044f-154
0.239
DAR-DIA-fc970077-5
0.239
VLA-UNK-792b5d03-2
0.238
MAR-TRE-2fd8122f-47
0.238
PET-UNK-4dc48bbe-5
0.237
MAR-TRE-74c6519b-47
0.237
BEN-DND-d1eb1f41-15
0.236
JUL-TUD-06b2044f-78
0.236
NIM-UNI-36e12f95-2
0.236
VLA-UNK-792b5d03-1
0.236
SAD-SAT-7d5528d9-43
0.235
JUL-TUD-06b2044f-90
0.235
CHR-SOS-7098f804-14
0.232
PET-UNK-94460c07-5
0.229
KEI-UNI-85a52787-6
0.229
NIM-UNI-363644a0-1
0.229
VLA-UNK-3a43cd95-1
0.228
NIM-UNI-0ea3b7bf-4
0.228
MIH-UNI-e573136b-2
0.227
SIM-SYN-a98e6a07-5
0.225
MAK-UNK-de9577cf-11
0.225
MAK-UNK-9a6be56d-23
0.225
MAK-UNK-9a6be56d-22
0.225
MAK-UNK-5d2caa6f-1
0.224
PET-UNK-4dc48bbe-3
0.224
AAR-UNI-c25c2f1e-49
0.223
KEI-UNI-85a52787-1
0.223
KEI-UNI-85a52787-5
0.223
MAK-UNK-9a6be56d-29
0.223
MAK-UNK-9a6be56d-31
0.223