Molecular Properties | |
SMILES: | C[C@H](NC(=O)C(F)F)c1cccc(F)c1 |
MW: | 217.19 |
Fraction sp3: | 0.3 |
HBA: | 1 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 29.1 |
cLogP: | 2.268 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Source | |
Enamine REAL: | Z32586657 |
Enamine Extended REAL: | s_22____14933938____58886 |
JON-UIO-066ce08b-7
0.600
MAR-LAB-ca4662a6-4
0.436
AUS-ARG-7cfdce8f-12
0.366
AAR-POS-0daf6b7e-10
0.345
WIL-UNI-1faa9b10-9
0.333
GIA-UNK-7337c2f3-5
0.319
MAR-TRE-66ac689e-68
0.314
WIL-UNI-1faa9b10-11
0.311
WIL-UNI-1faa9b10-52
0.307
GIA-UNK-4de5abb1-4
0.306
WIL-UNI-1faa9b10-6
0.306
WIL-UNI-1faa9b10-17
0.303
WIL-UNI-1faa9b10-31
0.299
DAV-CRI-3edb475e-6
0.295
MAR-TRE-92684b97-18
0.293
WIL-UNI-1faa9b10-45
0.292
JAR-KUA-8c13982c-20
0.291
JON-UIO-d28d79fe-8
0.286
WIL-UNI-1faa9b10-7
0.286
MAR-TRE-66ac689e-72
0.282
JON-UIO-066ce08b-13
0.281
MAR-TRE-799db12b-73
0.274
MAR-TRE-66ac689e-22
0.274
MAR-TRE-66ac689e-27
0.274
BAR-COM-0f94fc3d-56
0.274
WIL-UNI-1faa9b10-15
0.273
BAR-COM-0f94fc3d-13
0.271
MAK-UNK-6435e6c2-5
0.270
MAR-TRE-9d18ae8c-62
0.267
JAR-KUA-41bd5a3d-7
0.266
MAR-TRE-6a44bbf2-81
0.266
MAR-TRE-66ac689e-45
0.263
KEI-TRE-d5e2018a-25
0.263
MAR-TRE-799db12b-36
0.263
JON-UIO-82a15e73-12
0.260
JOH-IMS-1436231f-5
0.255
DAV-CRI-3edb475e-1
0.254
NIM-UNI-bb9030bf-5
0.254
JON-UIO-d28d79fe-5
0.253
MAR-TRE-9d18ae8c-9
0.253
LON-WEI-b2874fec-24
0.253
AAR-UNI-c25c2f1e-67
0.253
LON-WEI-adc59df6-66
0.253
MAR-TRE-8190bb11-36
0.250
WIL-UNI-1faa9b10-24
0.250
PAU-WEI-5b8d5051-2
0.247
SAD-SAT-1f400d17-4
0.247
CAS-DEP-751a2458-3
0.246
MAT-POS-f2460aef-4
0.245
LON-WEI-adc59df6-46
0.244
MAR-TRE-799db12b-45
0.244
MAR-TRE-799db12b-49
0.244
AAR-POS-d2a4d1df-2
0.243
PET-UNK-7d68125a-4
0.242
MAT-POS-02ae579f-1
0.242
KHR-WEI-75c61062-2
0.241
AAR-UNI-c25c2f1e-6
0.241
SUG-SAT-4be79373-4
0.241
ALP-POS-e980f4ea-12
0.240
MAK-UNK-942dcb71-3
0.240
JOH-IMS-1436231f-1
0.239
KHR-WEI-75c61062-1
0.239
ALP-POS-305f6ec3-49
0.237
ALP-POS-02c6a514-12
0.237
NAU-LAT-81109c57-1
0.237
LON-WEI-2e27a2e5-2
0.237
MAR-TRE-92684b97-77
0.236
DRR-IMP-38dce17f-2
0.235
DAN-MCD-5c762fbe-1
0.235
ALP-POS-305f6ec3-44
0.235
ALP-POS-02c6a514-11
0.234
ALP-POS-e980f4ea-28
0.234
LON-WEI-adc59df6-47
0.234
LON-POS-586a7c45-1
0.234
PAU-WEI-5b8d5051-1
0.234
ALF-EVA-719172df-6
0.234
MAR-TRE-92684b97-91
0.234
WIL-UNI-1faa9b10-44
0.234
JAR-KUA-8c13982c-1
0.233
ALP-POS-95b75b4d-1
0.233
WIL-UNI-1faa9b10-23
0.233
MAK-UNK-902cc841-8
0.233
ALP-POS-02c6a514-6
0.232
ALP-POS-02c6a514-49
0.232
ALP-POS-95f71980-25
0.232
ALP-POS-305f6ec3-14
0.232
JAG-UCB-cedd89ab-5
0.232
MAK-UNK-10dfa458-29
0.232
SAM-UNK-2684b532-5
0.231
SAM-UNK-2684b532-7
0.230
MAT-POS-f2460aef-1
0.229
MAT-POS-f2460aef-2
0.229
ALP-POS-02c6a514-26
0.229
ALP-POS-e980f4ea-27
0.229
LON-WEI-2e27a2e5-1
0.229
ALP-POS-95f71980-21
0.229
MAR-TRE-6c5ef77a-47
0.229
MAR-TRE-f5c2d31c-6
0.229
BEN-DND-76ad4ac9-4
0.229
JON-UNI-bb9dc649-11
0.229