Molecular Properties | |
SMILES: | O=S1(=O)CC(OC2CCN(Cc3ccsc3)CC2)C1 |
MW: | 301.433 |
Fraction sp3: | 0.69 |
HBA: | 5 |
HBD: | 0 |
Rotatable Bonds: | 4 |
TPSA: | 46.61 |
cLogP: | 1.5261 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✔️ |
Oxetanes, thietanes
LON-WEI-8f408cad-3
MAK-UNK-212f693e-15
0.517
AAR-POS-d2a4d1df-7
0.509
MAK-UNK-a7992eb3-16
0.485
MAK-UNK-a7992eb3-13
0.450
MAK-UNK-10dfa458-1
0.444
MAK-UNK-6435e6c2-3
0.426
MAK-UNK-a7992eb3-17
0.425
MAK-UNK-acefcb18-31
0.420
MAK-UNK-212f693e-6
0.419
MAK-UNK-212f693e-7
0.406
AAR-POS-0daf6b7e-13
0.400
LON-WEI-8f408cad-7
0.400
MAK-UNK-212f693e-8
0.400
MAK-UNK-10dfa458-20
0.394
MAK-UNK-a7992eb3-10
0.393
MAK-UNK-a7992eb3-14
0.386
MAK-UNK-a7992eb3-1
0.366
MAK-UNK-009ebe36-10
0.361
MAK-UNK-a7992eb3-11
0.358
MAK-UNK-a7992eb3-12
0.358
MAK-UNK-31051d4e-6
0.318
JAR-KUA-41bd5a3d-15
0.316
MAK-UNK-902cc841-2
0.306
MAK-UNK-1bb0b7ee-11
0.300
MAK-UNK-212f693e-16
0.294
MAK-UNK-acefcb18-30
0.294
MAK-UNK-212f693e-34
0.292
GIA-UNK-595fac82-5
0.284
MAK-UNK-acefcb18-29
0.278
AHN-SAT-02ef6d10-9
0.278
MAK-UNK-212f693e-35
0.274
MAK-UNK-e4a48a85-16
0.273
MAK-UNK-3f402c2b-22
0.273
MAK-UNK-212f693e-23
0.271
MAK-UNK-212f693e-31
0.270
MAK-UNK-212f693e-32
0.270
MAK-UNK-e4a48a85-15
0.269
JAR-KUA-8c13982c-7
0.269
MAK-UNK-e4a48a85-20
0.267
MAK-UNK-e4a48a85-21
0.264
MAK-UNK-31051d4e-5
0.261
MAK-UNK-212f693e-24
0.260
MAK-UNK-212f693e-18
0.257
MAK-UNK-212f693e-17
0.254
MAK-UNK-e4a48a85-22
0.253
MAK-UNK-212f693e-10
0.250
MAK-UNK-212f693e-21
0.250
MAK-UNK-212f693e-2
0.250
THO-SYG-98fc3427-10
0.247
JAR-KUA-672ec752-7
0.247
MAK-UNK-a7992eb3-22
0.247
MAK-UNK-212f693e-4
0.247
AHN-SAT-02ef6d10-2
0.241
GIA-UNK-5ec6c2b8-3
0.239
MAK-UNK-212f693e-27
0.237
MAK-UNK-acefcb18-27
0.237
MAK-UNK-212f693e-25
0.237
MAK-UNK-212f693e-29
0.237
MAK-UNK-212f693e-30
0.237
MAK-UNK-212f693e-33
0.237
THO-SYG-98fc3427-8
0.237
MAK-UNK-212f693e-14
0.236
MAK-UNK-212f693e-12
0.235
MAK-UNK-e4a48a85-24
0.234
MAK-UNK-212f693e-28
0.234
MAK-UNK-212f693e-22
0.234
MAK-UNK-212f693e-11
0.225
MAK-UNK-212f693e-26
0.225
MAK-UNK-e4a48a85-8
0.224
KUS-THE-322b9b63-17
0.222
MAK-UNK-194150d3-10
0.222
MAT-POS-ea426761-50
0.222
SAD-SAT-1f400d17-8
0.222
MAK-UNK-212f693e-19
0.221
MAK-UNK-1bb0b7ee-6
0.221
MAK-UNK-212f693e-3
0.218
MAK-UNK-212f693e-13
0.218
THO-SYG-98fc3427-11
0.216
ALP-POS-c0c213c9-12
0.216
MAK-UNK-212f693e-20
0.213
WAR-XCH-b6889685-19
0.212
MAK-UNK-ed378e62-29
0.211
JOO-PER-74f994a9-1
0.211
MAK-UNK-acefcb18-3
0.211
NJA-MAN-00c90aa2-6
0.211
MAK-UNK-e4a48a85-25
0.210
MED-COV-4280ac29-17
0.210
MAK-UNK-acefcb18-26
0.210
WAR-XCH-b6889685-12
0.209
NIM-UNI-7ba87d62-4
0.208
MAK-UNK-212f693e-9
0.208
UNK-UNK-2ede4078-98
0.208
ANN-UNI-26382800-7
0.207
MAR-TRE-14ce9fd6-99
0.206
THO-SYG-98fc3427-9
0.206
MAK-UNK-acefcb18-12
0.206
MAK-UNK-ec98eaf6-5
0.206
SAD-SAT-1f400d17-1
0.205
DAR-DIA-842b4336-10
0.205
SAD-SAT-7d5528d9-21
0.205