Molecular Properties | |
SMILES: | C[C@H](NC(=O)CNC(=O)CCl)c1ccc(F)cc1 |
MW: | 272.07 |
Fraction sp3: | 0.33 |
HBA: | 2 |
HBD: | 2 |
Rotatable Bonds: | 5 |
TPSA: | 58.2 |
cLogP: | 1.36 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Long aliphatic chain
Dipeptide
DAV-CRI-3edb475e-6
0.400
DAV-CRI-3edb475e-1
0.355
MAR-TRE-6a44bbf2-16
0.355
DAV-CRI-3edb475e-2
0.339
AAR-POS-0daf6b7e-10
0.339
MAR-TRE-4b834d9a-38
0.333
MAR-TRE-6a44bbf2-97
0.323
GIA-UNK-7337c2f3-4
0.310
MAR-TRE-6a44bbf2-85
0.308
MAR-TRE-6a44bbf2-57
0.306
JOK-SYG-b7365cd7-1
0.304
TAM-UNI-d1c3dd9f-22
0.293
MAR-TRE-6a44bbf2-90
0.292
DAV-CRI-3edb475e-3
0.288
DAV-CRI-14a23e73-2
0.287
DAV-CRI-14a23e73-1
0.286
DAV-CRI-14a23e73-4
0.284
TAM-UNI-d1c3dd9f-23
0.284
JON-UIO-82a15e73-4
0.282
AAR-POS-d2a4d1df-39
0.279
DEM-REL-172c3d60-4
0.278
JON-UIO-82a15e73-12
0.276
DEM-REL-172c3d60-2
0.273
WIL-UNI-1faa9b10-42
0.273
AAR-POS-0daf6b7e-8
0.271
SAD-SAT-65574d3f-7
0.271
MAK-UNK-f983951f-26
0.270
JON-UIO-d28d79fe-5
0.269
WAR-XCH-b6889685-48
0.269
MAR-TRE-87acfbcc-49
0.269
MAR-TRE-8190bb11-5
0.268
MAR-TRE-66ac689e-62
0.268
MAK-UNK-e0fdfe28-1
0.267
DAV-CRI-eab5efcb-6
0.267
DAV-CRI-eab5efcb-5
0.267
MAR-TRE-66ac689e-95
0.267
WIL-UNI-1faa9b10-24
0.266
JON-UIO-066ce08b-14
0.266
WIL-UNI-1faa9b10-1
0.265
JON-UIO-82a15e73-7
0.265
MAK-UNK-f983951f-22
0.262
SAD-SAT-29425be4-28
0.259
TAM-UNI-d1c3dd9f-24
0.259
DAV-CRI-14a23e73-5
0.259
MAK-UNK-f983951f-11
0.258
VIJ-CYC-1a381570-11
0.258
JON-UIO-82a15e73-6
0.257
JON-UIO-82a15e73-1
0.256
VIJ-CYC-1a381570-5
0.254
MAR-TRE-66ac689e-3
0.253
DEM-REL-172c3d60-5
0.253
DEM-REL-172c3d60-3
0.253
AAR-UNI-c25c2f1e-50
0.253
MAR-TRE-799db12b-99
0.253
DAV-CRI-eab5efcb-7
0.250
MAR-TRE-66ac689e-58
0.250
VIJ-CYC-1a381570-10
0.250
WIL-UNI-1faa9b10-56
0.250
MAR-TRE-87acfbcc-79
0.250
DAV-CRI-eab5efcb-3
0.247
DAV-CRI-eab5efcb-4
0.247
MAK-UNK-f983951f-16
0.246
DAV-CRI-14a23e73-6
0.244
WIL-UNI-1faa9b10-34
0.244
MAR-TRE-66ac689e-100
0.244
MAR-TRE-6a44bbf2-47
0.243
AAR-POS-d2a4d1df-2
0.243
MAR-TRE-87acfbcc-86
0.242
MAT-POS-162a9720-4
0.242
MAT-POS-162a9720-9
0.241
MAR-TRE-799db12b-100
0.241
MAR-TRE-66ac689e-85
0.241
DAV-CRI-eab5efcb-2
0.240
DAV-CRI-eab5efcb-8
0.240
DAV-CRI-eab5efcb-1
0.240
JON-UIO-066ce08b-7
0.240
MAK-UNK-0d6072ac-1
0.240
DAV-CRI-3edb475e-4
0.239
DRR-IMP-db50bf6e-1
0.239
AAR-UNI-c25c2f1e-84
0.239
TAM-UNI-d1c3dd9f-21
0.238
MAR-TRE-66ac689e-94
0.237
DUN-NEW-f8ce3686-21
0.237
NAU-LAT-81109c57-1
0.237
SAD-SAT-6b5a89f0-10
0.237
DAV-CRI-3edb475e-5
0.236
MAR-TRE-d0525fbf-97
0.236
WAL-WAB-df110a02-1
0.236
YOI-UNK-4c10088f-2
0.235
MAR-TRE-3e4e6814-3
0.235
AAR-UNI-c25c2f1e-17
0.235
RIT-RIT-fdc869b4-1
0.235
SAD-SAT-1b030f84-2
0.234
MAK-UNK-f983951f-23
0.234
JON-UIO-d28d79fe-8
0.234
MAR-TRE-6a44bbf2-98
0.233
MAR-TRE-6a44bbf2-5
0.232
AUS-ARG-7cfdce8f-12
0.232
MAR-TRE-6a44bbf2-73
0.231
SAD-SAT-65574d3f-2
0.231