Molecular Properties | |
SMILES: | O=C(Nc1cccc2cnccc12)C1CC1c1ccccc1 |
MW: | 288.13 |
Fraction sp3: | 0.16 |
HBA: | 2 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 41.99 |
cLogP: | 3.98 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Shipped: | 2021-05-26 |
UNK-UNK-2ede4078-50
0.506
ALF-EVA-a24cc7ce-5
0.453
UNK-UNK-2ede4078-35
0.449
UNK-UNK-2ede4078-56
0.448
ALF-EVA-a24cc7ce-1
0.443
UNK-UNK-2ede4078-51
0.429
UNK-UNK-2ede4078-23
0.427
UNK-UNK-2ede4078-22
0.409
UNK-UNK-2ede4078-30
0.400
UNK-UNK-2ede4078-61
0.398
UNK-UNK-2ede4078-13
0.376
LON-WEI-af038623-9
0.373
UNK-UNK-2ede4078-38
0.371
UNK-UNK-2ede4078-60
0.354
DAR-DIA-6a508060-11
0.318
PET-UNK-b78139fa-9
0.299
ERI-UCB-5b47150d-6
0.296
VLA-UNK-56836b69-4
0.296
MAR-TRE-92684b97-38
0.294
MAT-POS-bb423b95-1
0.292
JUL-TUD-06b2044f-47
0.290
ALP-POS-869ac754-2
0.289
JUL-TUD-06b2044f-51
0.287
FRA-DIA-0fa076fe-1
0.287
FRA-DIA-c7e803f4-1
0.287
MAT-POS-590ac91e-8
0.286
MAR-TRE-74c6519b-51
0.286
SAD-SAT-f2e2579e-1
0.286
ALP-UNI-8d415491-3
0.286
MAT-POS-590ac91e-18
0.284
MAR-TRE-4b834d9a-26
0.283
BEN-DND-34fc7f90-1
0.283
BEN-DND-34fc7f90-7
0.283
DUN-NEW-d8381160-1
0.281
MIH-UNI-3396182e-10
0.281
EDJ-MED-e4b030d8-12
0.280
MAT-POS-8e4737f4-2
0.280
BEN-DND-4f474d93-1
0.280
BEN-DND-4f474d93-3
0.280
ALP-POS-ce760d3f-2
0.280
RAL-THA-05e671eb-33
0.280
RAL-THA-05e671eb-21
0.278
RAL-THA-2d450e86-34
0.278
PET-UNK-2c6614b6-9
0.277
DAR-DIA-6a508060-12
0.277
BEN-DND-34fc7f90-4
0.275
ALP-POS-347519b5-1
0.275
PET-UNK-1e13ef09-5
0.275
WIL-UNI-5578df48-10
0.274
RAL-THA-2d450e86-1
0.274
SAD-SAT-2ceae68f-7
0.274
MAR-UCB-6ab2ec87-2
0.273
JUL-TUD-06b2044f-46
0.272
PET-UNK-f4e47ebd-6
0.272
LON-WEI-af038623-3
0.269
BAR-COM-0f94fc3d-59
0.269
RAL-THA-05e671eb-1
0.268
MIC-UNK-8758c41d-2
0.267
EDJ-MED-e4b030d8-9
0.267
MAT-POS-fb82b63d-1
0.267
RAL-THA-05e671eb-34
0.267
VLA-UNK-82501c2c-1
0.267
PET-UNK-f4e47ebd-10
0.267
ANT-OPE-6a16a9ad-1
0.266
FRA-DIA-0fa076fe-2
0.265
BEN-DND-11faade0-1
0.265
MED-COV-4280ac29-20
0.265
RAL-THA-05e671eb-22
0.265
JUL-TUD-06b2044f-45
0.265
JUL-TUD-06b2044f-54
0.265
MAT-POS-865c3497-1
0.265
MAT-POS-865c3497-2
0.265
ROB-UNI-322e8f70-3
0.265
ROB-UNI-7b37d95b-1
0.265
MIC-UNK-91acba05-1
0.265
MAT-POS-22e8b45a-1
0.265
RAL-THA-05e671eb-12
0.265
MAK-UNK-f481d203-4
0.264
RYA-UNI-14580791-1
0.264
MAK-UNK-919546f0-2
0.264
MAK-UNK-f481d203-3
0.264
ALF-EVA-b701bd13-4
0.263
ALP-UNI-c3ef0aba-1
0.263
ALF-EVA-82cf4849-1
0.262
ALP-POS-f1807566-1
0.262
MAT-POS-acfe5bae-6
0.262
UNK-UNK-2ede4078-5
0.262
SCO-VAN-260d9628-2
0.262
MAT-POS-590ac91e-12
0.262
RAL-THA-4aa06b95-3
0.262
RAL-THA-2d450e86-38
0.261
RAL-THA-2d450e86-23
0.261
MAR-UCB-6ab2ec87-1
0.260
PET-UNK-022eab87-1
0.260
ALP-POS-d3acb8cc-1
0.260
ALP-POS-d3acb8cc-4
0.260
MAT-POS-8a69d52e-1
0.260
ALP-POS-d3acb8cc-2
0.260
MAT-POS-8a69d52e-2
0.260
ALP-POS-d3acb8cc-3
0.260