Molecular Properties | |
SMILES: | Cc1cccc(CS(=O)(=O)N2CCC(C(N)=O)CC2)c1 |
MW: | 296.12 |
Fraction sp3: | 0.5 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 80.47 |
cLogP: | 1.02 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z1003140064 |
Mcule: | MCULE-9315593201 |
Mcule Ultimate: | LMOKMFWACAPXAU-UHFFFAOYSA-N |
MolPort: | MolPort-006-800-826 |
Order Status | |
Ordered: | 2020-05-30 |
Synthesis Location: | enamine |
Shipped: | 2020-06-24 |
Hetero_hetero
MAR-TRE-fd17a9b8-16
0.391
MAK-UNK-10dfa458-10
0.356
WIL-LEE-23e8b574-1
0.353
MAK-UNK-af83ef51-6
0.351
MAR-TRE-fd17a9b8-47
0.342
MAR-TRE-fd17a9b8-50
0.341
MAK-UNK-af83ef51-9
0.341
MAK-UNK-af83ef51-8
0.338
MAK-UNK-10dfa458-12
0.337
MAK-UNK-7c9d1431-23
0.333
MAR-TRE-6a44bbf2-28
0.333
MAR-TRE-fd17a9b8-22
0.326
MAR-TRE-fd17a9b8-4
0.325
MAK-UNK-e4a48a85-9
0.324
MAK-UNK-af83ef51-7
0.321
MAK-UNK-af83ef51-5
0.321
STU-CHA-0be58c98-1
0.318
MAK-UNK-10dfa458-11
0.316
AAR-POS-d2a4d1df-24
0.315
STU-CHA-07310c75-1
0.310
JOO-PER-74f994a9-1
0.306
NIR-THE-0d6461ce-1
0.295
BEN-DND-76ad4ac9-6
0.293
MAR-TRE-fd17a9b8-15
0.293
MAK-UNK-10799360-5
0.292
BEN-DND-76ad4ac9-9
0.287
MAK-UNK-3f402c2b-3
0.287
BEN-DND-03406596-1
0.287
SAD-SAT-c989feaa-8
0.287
SEL-UNI-cd366922-9
0.282
JAN-GHE-1d98ec1c-6
0.280
JAG-UCB-ef2c0e8e-6
0.280
MAR-TRE-fd17a9b8-56
0.280
LOR-NOR-30067bb9-2
0.279
RAF-POL-b61b4b25-9
0.278
SAD-SAT-29425be4-18
0.278
MAK-UNK-10799360-3
0.278
CLI-UNI-032f7715-3
0.278
MAK-UNK-e4a48a85-11
0.277
DRA-CSI-3ab97369-4
0.277
KAI-MCD-cb49037b-1
0.276
MAR-TRE-3e4e6814-54
0.275
AAR-POS-0daf6b7e-32
0.274
MAK-UNK-af83ef51-10
0.274
MAK-UNK-af83ef51-11
0.273
MAR-TRE-fd17a9b8-65
0.272
GIA-UNK-5ec6c2b8-4
0.271
MAK-UNK-27459e11-15
0.270
SAD-SAT-5b1897b2-4
0.270
WAR-XCH-b6889685-16
0.267
SAD-SAT-29425be4-20
0.267
MAR-TRE-fd17a9b8-6
0.267
MAK-UNK-750cfbcc-1
0.266
MAR-TRE-fd17a9b8-92
0.265
MAR-TRE-fd17a9b8-64
0.264
BEN-DND-76ad4ac9-2
0.263
WAR-XCH-b6889685-27
0.262
MED-COV-4280ac29-7
0.262
RED-RED-10c9212c-24
0.262
MAK-UNK-3e0761f8-4
0.261
MAK-UNK-e4a48a85-10
0.260
MAT-POS-ea426761-92
0.260
MAK-UNK-e4a48a85-17
0.260
MIH-UNI-e573136b-7
0.256
JOH-UNI-c7afdb96-8
0.253
GIA-UNK-7337c2f3-8
0.253
WAR-XCH-b6889685-6
0.253
MAR-TRE-3e4e6814-51
0.252
AGN-NEW-c7b24fe3-6
0.250
WAR-XCH-72a8c209-3
0.250
GIA-UNK-5ec6c2b8-3
0.250
WAR-XCH-b6889685-58
0.250
MAK-UNK-27459e11-10
0.250
AGN-NEW-c7b24fe3-3
0.250
WAR-XCH-b72a1bbc-45
0.250
MED-COV-4280ac29-4
0.250
MED-COV-4280ac29-23
0.250
AAR-POS-d2a4d1df-36
0.250
AGN-NEW-c7b24fe3-2
0.247
MAR-TRE-fd17a9b8-100
0.247
MAR-TRE-f5c2d31c-48
0.247
ALP-POS-95b75b4d-9
0.247
JOH-UNI-c7afdb96-7
0.247
BEN-DND-76ad4ac9-1
0.247
MAR-TRE-b77b7921-11
0.245
MAK-UNK-ec98eaf6-32
0.244
MAK-UNK-7c9d1431-19
0.244
DRA-CSI-47e38074-2
0.243
MAR-TRE-f6f5f473-72
0.243
MAK-UNK-69bf97dd-1
0.242
MAR-TRE-fd17a9b8-2
0.242
NIR-THE-0d6461ce-12
0.242
KEI-TRE-d5e2018a-36
0.242
CHA-MCP-85291e1d-6
0.241
JOH-UNI-c7afdb96-6
0.241
AHN-SAT-02ef6d10-3
0.240
GIA-UNK-5ec6c2b8-5
0.240
PEI-IMP-ca0b2813-3
0.238
JAN-GHE-1d98ec1c-8
0.238
DRR-IMP-dff87f5e-8
0.237