Molecular Properties | |
SMILES: | CS(=O)(=O)Nc1cnccc1C1CC1 |
MW: | 212.274 |
Fraction sp3: | 0.44 |
HBA: | 3 |
HBD: | 1 |
Rotatable Bonds: | 3 |
TPSA: | 59.06 |
cLogP: | 1.3305 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Hetero_hetero
MAK-UNK-6435e6c2-8
IND-SYN-2c708b29-2
0.489
JOH-IMS-d6628593-2
0.466
ALP-POS-df536be7-3
0.408
EDJ-MED-3c65e9ce-2
0.403
ALP-POS-95b75b4d-5
0.397
MAT-POS-bb423b95-4
0.397
ALP-POS-95b75b4d-10
0.380
ALP-UNI-8d415491-1
0.338
SAD-SAT-7d5528d9-6
0.333
EDJ-MED-e9694d2b-1
0.329
ERI-UCB-9c7ec71b-2
0.329
MAK-UNK-6ca90168-27
0.321
SAD-SAT-7d5528d9-25
0.321
SAD-SAT-7d5528d9-35
0.309
MAT-POS-590ac91e-5
0.308
ALP-POS-d054b76b-7
0.304
EDG-MED-0da5ad92-4
0.303
MAR-TRE-9c797165-9
0.303
TRY-UNI-714a760b-10
0.303
ALE-HEI-f28a35b5-6
0.303
AAR-POS-d2a4d1df-3
0.302
MAK-UNK-6435e6c2-8
0.302
JAN-GHE-83b26c96-17
0.300
SIM-DEM-f31d0e65-1
0.297
ASH-UNK-40b46b30-11
0.293
MAK-UNK-6ca90168-26
0.293
MAT-POS-590ac91e-18
0.292
MAT-POS-590ac91e-19
0.292
SAD-SAT-24589cd1-9
0.291
MAT-POS-590ac91e-7
0.288
TRY-UNI-714a760b-11
0.288
ALE-HEI-f28a35b5-7
0.288
ALE-HEI-f28a35b5-12
0.286
MAT-POS-590ac91e-14
0.286
WIL-MOD-03b86a88-5
0.286
MAK-UNK-372b0df5-3
0.286
MAT-POS-590ac91e-12
0.284
MAT-POS-590ac91e-22
0.284
BEN-DND-09b88bf4-3
0.282
BEN-DND-6de5dfa0-3
0.282
MAT-POS-590ac91e-29
0.282
NAU-LAT-3f5f3993-5
0.282
ALP-POS-95b75b4d-4
0.280
MAT-POS-590ac91e-10
0.279
JAN-GHE-83b26c96-21
0.279
AGN-NEW-95323f67-1
0.276
AGN-NEW-9315dc74-5
0.276
TRY-UNI-714a760b-16
0.275
MAT-POS-590ac91e-21
0.275
TRY-UNI-bbd40bb4-6
0.275
PET-SGC-6e7c5dc0-1
0.273
MAK-UNK-372b0df5-2
0.273
NAU-LAT-3f5f3993-10
0.272
GAB-REV-70cc3ca5-20
0.271
WAR-XCH-b72a1bbc-17
0.271
NAU-LAT-3f5f3993-2
0.271
EDJ-MED-3c65e9ce-4
0.271
ANT-DIA-b7f58f21-1
0.271
ERI-UCB-5b47150d-4
0.270
ADA-UCB-6c2cb422-2
0.269
MAK-UNK-372b0df5-1
0.269
ALP-POS-e0fe77e5-3
0.269
ERI-UCB-5b47150d-6
0.269
GAB-REV-70cc3ca5-3
0.267
ALE-HEI-f28a35b5-13
0.266
CHA-KIN-f512e507-1
0.265
MAK-UNK-919546f0-1
0.265
MAK-UNK-f481d203-1
0.265
MAK-UNK-f481d203-2
0.265
MAT-POS-590ac91e-23
0.265
DAR-DIA-6a508060-12
0.265
SAD-SAT-24589cd1-10
0.264
EDG-MED-0da5ad92-9
0.264
MAT-POS-590ac91e-28
0.264
DRE-WAB-eb790b7a-1
0.263
DAN-RED-da448e80-1
0.263
PED-UNI-8d53fd73-1
0.263
PED-UNI-5b7f1100-1
0.263
MIH-UNI-6b9ca91a-3
0.262
MAT-POS-590ac91e-24
0.261
MAT-POS-590ac91e-26
0.261
MAT-POS-590ac91e-4
0.261
MAT-POS-590ac91e-25
0.260
MAR-TRE-74c6519b-57
0.260
MAK-UNK-f0bfc2e0-2
0.260
DAN-RED-da448e80-17
0.260
CHA-KIN-f512e507-2
0.259
TRY-UNI-bbd40bb4-5
0.259
ASH-SAT-43770c7d-9
0.258
MAT-POS-590ac91e-1
0.258
ERI-UCB-5b47150d-1
0.258
MAT-POS-590ac91e-2
0.258
ALE-HEI-f28a35b5-17
0.258
SCO-VAN-260d9628-1
0.258
MAR-TRE-c317dd82-88
0.258
JAN-GHE-83b26c96-11
0.258
MAT-POS-590ac91e-3
0.257
MAT-POS-590ac91e-8
0.257
CHA-KIN-ceadbd93-2
0.257
NAU-LAT-445f63e5-3
0.257