Molecular Properties | |
SMILES: | C=CC(=O)N1CCCN(S(=O)(=O)c2cccc3cnccc23)CC1 |
MW: | 345.11 |
Fraction sp3: | 0.29 |
HBA: | 4 |
HBD: | 0 |
Rotatable Bonds: | 3 |
TPSA: | 70.58 |
cLogP: | 1.64 |
Covalent Warhead: | ✔️ |
Covalent Fragment: | ✗ |
Source | |
Enamine BB: | EN300-26598036 |
Enamine SCR: | Z2285377475 |
Enamine REAL: | Z2285377475 |
Enamine Extended REAL: | m_273270____10883100____10884640 |
Mcule: | MCULE-4573089249 |
MolPort: | MolPort-039-313-084 |
Hetero_hetero
AAR-POS-d2a4d1df-2
SAD-SAT-2ceae68f-2
0.679
SAD-SAT-f2e2579e-1
0.591
PEI-IMP-3d837503-2
0.387
DRR-IMP-db50bf6e-4
0.386
BEN-DND-03ad4429-7
0.372
MAK-UNK-10dfa458-4
0.372
JAG-SYN-9c2cd0bd-1
0.372
BEN-DND-03ad4429-3
0.362
MAK-UNK-10dfa458-5
0.362
JAN-GHE-4287bd1a-1
0.354
SAD-SAT-b55127ae-5
0.350
MAK-UNK-10dfa458-18
0.342
LON-WEI-af038623-9
0.337
SAD-SAT-3a925b8b-10
0.329
MAK-UNK-10dfa458-6
0.325
SAD-SAT-2ceae68f-4
0.323
JAN-GHE-bf40f168-2
0.321
UNK-UNK-2ede4078-40
0.320
BEN-DND-76ad4ac9-11
0.318
BEN-DND-03406596-9
0.318
NAU-LAT-c9bfe74c-3
0.314
SAD-SAT-b55127ae-3
0.309
BEN-DND-76ad4ac9-13
0.307
BEN-DND-03406596-5
0.307
AHN-SAT-02ef6d10-5
0.302
SAD-SAT-b55127ae-4
0.301
AHN-SAT-b1e6fbb2-1
0.300
SAD-SAT-1f400d17-10
0.299
PEI-IMP-ca0b2813-4
0.295
ANT-OPE-c0c3e7cc-1
0.294
BEN-DND-03406596-2
0.292
BEN-DND-76ad4ac9-12
0.292
BEN-DND-76ad4ac9-14
0.289
BEN-DND-03406596-3
0.289
AHN-SAT-02ef6d10-7
0.288
NIR-THE-b7e8e081-1
0.286
UNK-UNK-2ede4078-30
0.284
JAN-GHE-bf40f168-1
0.283
SAD-SAT-b55127ae-2
0.283
SAD-SAT-6b5a89f0-9
0.281
BEN-DND-03406596-6
0.280
BEN-DND-76ad4ac9-10
0.280
PEI-IMP-ca0b2813-1
0.279
SAD-SAT-f2e2579e-8
0.277
MAK-UNK-7264f48c-5
0.276
PEI-IMP-ca0b2813-2
0.274
UNK-UNK-2ede4078-32
0.274
MAK-UNK-6ca90168-2
0.273
SAD-SAT-b55127ae-9
0.270
MAK-UNK-7264f48c-1
0.268
MAK-UNK-7264f48c-4
0.267
JOO-IND-6372a4f3-4
0.267
BEN-DND-03406596-8
0.267
MAR-TRE-3159af1a-36
0.265
MAR-TRE-3159af1a-43
0.265
MAK-UNK-7264f48c-6
0.265
MAR-TRE-3159af1a-81
0.264
UNK-UNK-2ede4078-35
0.264
MAR-TRE-3159af1a-65
0.263
MAK-UNK-7264f48c-3
0.262
MAR-TRE-3159af1a-32
0.262
NAU-LAT-64f4b287-1
0.260
SAD-SAT-135344c3-3
0.260
UNK-UNK-2ede4078-56
0.260
JAR-IMP-ed466bb3-15
0.259
UNK-UNK-2ede4078-23
0.258
JAN-GHE-d851b096-5
0.258
MAK-UNK-7264f48c-2
0.257
MAK-UNK-6ca90168-12
0.256
MAK-UNK-7c9d1431-12
0.256
UNK-UNK-2ede4078-61
0.255
MAR-TRE-3159af1a-42
0.255
MAK-UNK-10dfa458-8
0.253
BEN-DND-03ad4429-8
0.253
NIM-UNI-310206f0-69
0.253
PEI-IMP-668afc53-1
0.253
UNK-UNK-2ede4078-22
0.252
NAU-LAT-c9bfe74c-4
0.252
MAR-TRE-3159af1a-61
0.252
JUL-TUD-06b2044f-45
0.252
SAD-SAT-2ceae68f-3
0.252
SAD-SAT-9a6c5cf3-4
0.252
NAU-LAT-c9bfe74c-2
0.252
JOO-IND-b13e14cc-1
0.250
MAT-POS-4e253971-2
0.250
ALF-EVA-a24cc7ce-5
0.250
UNK-UNK-2ede4078-51
0.250
SAD-SAT-2ceae68f-1
0.250
SAD-SAT-2fd372d1-10
0.250
SAD-SAT-f2e2579e-9
0.250
GAB-REV-70cc3ca5-8
0.250
DRR-IMP-dff87f5e-5
0.250
AAR-POS-d2a4d1df-34
0.250
AHN-SAT-02ef6d10-3
0.250
MAR-TRE-6a44bbf2-8
0.250
SAD-SAT-1f400d17-4
0.248
BEN-DND-03ad4429-4
0.247
SAD-SAT-2fd372d1-9
0.247
MAK-UNK-10dfa458-10
0.247
MED-COV-4280ac29-14
0.247