Molecular Properties | |
SMILES: | C=CC(=O)NCCCNc1cccc2cnccc12 |
MW: | 255.14 |
Fraction sp3: | 0.2 |
HBA: | 3 |
HBD: | 2 |
Rotatable Bonds: | 6 |
TPSA: | 54.02 |
cLogP: | 2.34 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-06-15 |
Synthesis Location: | enamine |
Shipped: | synthesis in progress |
Aliphatic long chain
Long aliphatic chain
UNK-UNK-2ede4078-38
0.395
UNK-UNK-2ede4078-22
0.386
UNK-UNK-2ede4078-23
0.386
UNK-UNK-2ede4078-61
0.375
UNK-UNK-2ede4078-32
0.373
UNK-UNK-2ede4078-51
0.372
UNK-UNK-2ede4078-50
0.364
UNK-UNK-2ede4078-30
0.363
UNK-UNK-2ede4078-35
0.351
UNK-UNK-2ede4078-56
0.348
ALF-EVA-a24cc7ce-1
0.344
UNK-UNK-2ede4078-13
0.340
SAD-SAT-2ceae68f-7
0.337
ALF-EVA-a24cc7ce-5
0.337
LON-WEI-af038623-3
0.329
UNK-UNK-2ede4078-60
0.320
MAT-POS-bb423b95-1
0.314
SAD-SAT-2ceae68f-2
0.301
LON-WEI-af038623-2
0.282
MAK-UNK-6ca90168-27
0.278
VLA-UNK-82501c2c-1
0.273
MAR-TRE-c8530538-32
0.269
SAD-SAT-f2e2579e-1
0.267
JUL-TUD-06b2044f-51
0.266
LON-WEI-af038623-7
0.265
MAT-POS-e6dd326d-8
0.264
MAK-UNK-6ca90168-28
0.263
SAD-SAT-1f400d17-7
0.260
JUL-TUD-06b2044f-45
0.257
RAL-THA-2d450e86-34
0.256
MAK-UNK-ca11b4f7-2
0.254
NIM-NMI-8bb27a2b-2
0.252
JUA-UNI-a9dfaed1-5
0.250
BEN-DND-34fc7f90-1
0.250
LON-WEI-af038623-6
0.250
MAT-POS-f7918075-5
0.250
EDJ-MED-2f867453-2
0.250
RAL-THA-2d450e86-11
0.247
SAD-SAT-b55127ae-8
0.247
MAK-UNK-c749d764-11
0.247
NIM-UNI-bb9030bf-6
0.247
ALE-HEI-f28a35b5-11
0.247
DAV-IMP-59dd6621-16
0.247
LON-WEI-babf2c61-10
0.245
LON-WEI-babf2c61-13
0.245
MAT-POS-c0143b99-1
0.245
ADA-UCB-6c2cb422-1
0.244
RAL-THA-2d450e86-10
0.244
LON-WEI-babf2c61-12
0.243
ALP-POS-76eab5ce-2
0.242
MAT-POS-afd4d4fd-2
0.242
MAT-POS-afd4d4fd-3
0.242
BEN-DND-61647d40-15
0.242
MAK-UNK-919546f0-5
0.241
LON-POS-586a7c45-1
0.241
LON-WEI-babf2c61-2
0.241
PAU-WEI-5b8d5051-1
0.241
LON-WEI-adc59df6-47
0.241
IVS-FNM-f9a14d04-1
0.240
ALP-UNI-8d415491-3
0.240
JAN-GHE-d851b096-1
0.240
LON-WEI-af038623-1
0.240
RAL-THA-2d450e86-26
0.239
RAL-THA-2d450e86-23
0.239
RAL-THA-2d450e86-7
0.239
RAL-THA-2d450e86-38
0.239
LON-WEI-babf2c61-4
0.239
NIM-UNI-bb9030bf-4
0.238
BEN-DND-34fc7f90-7
0.238
UNK-UNK-2ede4078-40
0.238
ALE-HEI-f28a35b5-12
0.237
DAR-DIA-48c639f7-11
0.237
ALP-POS-f13221e1-3
0.237
MIC-UNK-50cce87d-3
0.237
RUB-POS-1325a9ea-3
0.237
RAL-THA-2d450e86-16
0.236
RAL-THA-2d450e86-35
0.236
MAK-UNK-c749d764-6
0.236
MAK-UNK-ffc90da7-1
0.236
ALP-POS-95b75b4d-8
0.235
RAL-THA-2d450e86-1
0.235
SAM-UNK-2684b532-13
0.235
VLA-UNK-82501c2c-3
0.235
JIN-POS-6dc588a4-11
0.234
PET-UNK-3c72d439-1
0.234
UNK-UNK-2ede4078-59
0.234
LON-WEI-adc59df6-66
0.234
PET-UNK-e8c7a26f-2
0.233
MAT-POS-c74bc7b3-1
0.233
PET-UNK-2c6614b6-9
0.233
LON-WEI-adc59df6-27
0.233
MAT-POS-c74bc7b3-2
0.233
CHE-UNK-35529387-1
0.233
CHE-UNK-35529387-2
0.233
MAK-UNK-919546f0-4
0.233
ALP-POS-df536be7-5
0.232
DAR-DIA-0cde14eb-54
0.232
VLA-UCB-05e51b3f-16
0.232
NAT-WAB-78d8bb1c-2
0.232
DAR-DIA-076fb6ea-1
0.232