Molecular Properties | |
SMILES: | NC(=O)C1CCN(c2nnc(C3CCC(=O)N3)n2CCc2cc(F)cc(F)c2)CC1 |
MW: | 418.448 |
Fraction sp3: | 0.5 |
HBA: | 6 |
HBD: | 2 |
Rotatable Bonds: | 6 |
TPSA: | 106.14 |
cLogP: | 1.4518 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Source | |
Enamine Extended REAL: | m_273170____10757354____10759928____13935884 |
MolPort: | MolPort-047-477-347 |
Order Status | |
Ordered: | 2020-04-29 |
Synthesis Location: | enamine |
Shipped: | 2020-06-01 |
KUS-THE-322b9b63-12
0.505
KUS-THE-322b9b63-17
0.459
KUS-THE-322b9b63-11
0.439
KUS-THE-322b9b63-23
0.433
KUS-THE-322b9b63-2
0.416
KUS-THE-322b9b63-14
0.400
KUS-THE-322b9b63-25
0.398
KUS-THE-322b9b63-5
0.377
KUS-THE-322b9b63-7
0.362
KUS-THE-322b9b63-15
0.352
KUS-THE-322b9b63-22
0.327
KUS-THE-322b9b63-21
0.321
KUS-THE-322b9b63-8
0.292
KUS-THE-322b9b63-24
0.244
MAR-TRE-e86a56b5-8
0.233
JAG-UCB-ef2c0e8e-8
0.232
MAR-TRE-e86a56b5-12
0.229
MAR-TRE-3159af1a-1
0.227
MAR-TRE-fd17a9b8-50
0.226
ALP-POS-95f71980-34
0.226
TIM-UNK-bcd886f8-1
0.224
MAR-TRE-fd17a9b8-47
0.223
MAR-TRE-fd17a9b8-16
0.221
MAR-TRE-fd17a9b8-22
0.218
MAR-TRE-fd17a9b8-65
0.218
MAR-TRE-fd17a9b8-98
0.216
AAR-POS-0daf6b7e-32
0.215
MAR-TRE-fd17a9b8-4
0.215
TAT-ENA-80bfd3e5-12
0.206
MAR-TRE-799db12b-7
0.206
MAR-TRE-0fda4e82-16
0.206
MAR-TRE-f5c2d31c-23
0.205
CLI-UNI-032f7715-3
0.204
MAK-UNK-750cfbcc-1
0.202
MAR-TRE-f5c2d31c-48
0.200
MAR-TRE-fd17a9b8-40
0.200
MAR-TRE-7f7bb9f0-7
0.200
BRU-UNI-248b30bc-46
0.199
RED-RED-10c9212c-48
0.197
MAR-TRE-7f7bb9f0-71
0.197
MAR-TRE-4b834d9a-58
0.197
MEL-NAT-8c3652c8-3
0.196
GIA-UNK-5ec6c2b8-3
0.196
MAR-TRE-7f7bb9f0-3
0.195
MAR-TRE-be9ff7d2-75
0.195
KAI-MCD-cb49037b-1
0.194
MAR-TRE-3159af1a-21
0.194
WAR-XCH-72a8c209-3
0.193
MAR-TRE-b77b7921-21
0.192
VIT-UNK-cff011c0-3
0.192
RAL-MED-2de63afb-14
0.191
BOG-INS-da52c1c2-1
0.190
MAR-TRE-d0525fbf-70
0.190
MAR-TRE-a9136c7b-31
0.190
MAR-TRE-fd17a9b8-2
0.190
BEN-DND-031a96cc-7
0.190
JAN-GHE-4287bd1a-6
0.189
MAR-TRE-67513f76-72
0.189
MAR-TRE-7f7bb9f0-22
0.189
MAR-TRE-2fd8122f-74
0.189
MAR-TRE-d0525fbf-94
0.187
RAL-THA-901e9a10-2
0.186
BEN-DND-031a96cc-6
0.186
VIT-UNK-cff011c0-1
0.186
MAR-TRE-4b834d9a-98
0.186
SAD-SAT-5b1897b2-5
0.186
MAR-TRE-fd17a9b8-6
0.186
BEN-VAN-d8fd1356-28
0.186
AAR-UNI-c25c2f1e-68
0.186
KUS-THE-322b9b63-6
0.185
BEN-DND-76ad4ac9-2
0.184
JUL-TUD-06b2044f-152
0.183
MAR-TRE-fd17a9b8-36
0.183
MAR-TRE-fd17a9b8-15
0.182
BEN-DND-76ad4ac9-6
0.182
BRU-THA-92256091-89
0.182
MAR-TRE-67513f76-15
0.181
MAR-TRE-3e4e6814-20
0.181
BEN-DND-76ad4ac9-3
0.181
MAR-TRE-d0525fbf-88
0.180
GIA-UNK-995df016-16
0.180
MAR-TRE-04c86cea-54
0.180
JUL-TUD-06b2044f-131
0.179
NJA-MAN-00c90aa2-41
0.179
MAR-TRE-8190bb11-27
0.179
FAR-UNI-736b943a-2
0.179
MAR-TRE-d0525fbf-32
0.178
MIC-UNK-42806bd5-2
0.178
ALP-POS-8b8a49e1-5
0.178
ALP-POS-90e38439-3
0.178
BRU-THA-92256091-90
0.178
MAR-TRE-fd17a9b8-11
0.178
JUL-TUD-06b2044f-132
0.178
MAK-UNK-704ed37c-15
0.178
MAR-TRE-fd17a9b8-100
0.178
MAR-TRE-67513f76-62
0.177
MAK-UNK-10799360-27
0.177
BRU-THA-92256091-45
0.177
MAR-TRE-e82e6c98-33
0.177
LON-WEI-b2874fec-4
0.177