Molecular Properties | |
SMILES: | NS(=O)(=O)c1cnn(CC(=O)Nc2cccnc2)c1 |
MW: | 281.06 |
Fraction sp3: | 0.1 |
HBA: | 6 |
HBD: | 2 |
Rotatable Bonds: | 4 |
TPSA: | 119.97 |
cLogP: | -0.44 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Enamine REAL: | Z968668388 |
MAR-TRE-c317dd82-59
0.521
MAR-TRE-2fd8122f-37
0.507
TAM-UNI-c140e31a-13
0.487
CHA-MCP-85291e1d-2
0.486
MAR-TRE-67513f76-81
0.482
TAM-UNI-c140e31a-7
0.475
TAM-UNI-c140e31a-12
0.475
TAM-UNI-c140e31a-14
0.469
TAM-UNI-c140e31a-6
0.469
CHA-MCP-85291e1d-4
0.466
JOH-IMS-62aeb97d-5
0.466
MAK-UNK-ca11b4f7-1
0.466
TAM-UNI-c140e31a-1
0.458
MAR-TRE-04c86cea-40
0.452
CHR-SOS-70e4c98a-11
0.447
DAR-DIA-842b4336-11
0.441
CHA-MCP-85291e1d-5
0.438
MAR-TRE-9c797165-57
0.436
NAU-LAT-64f4b287-10
0.432
MAR-TRE-67513f76-73
0.431
CHR-SOS-e960e883-3
0.430
MAR-TRE-7f7bb9f0-49
0.429
KEI-TRE-d5e2018a-74
0.429
MAR-TRE-b77b7921-91
0.427
CHR-SOS-70e4c98a-7
0.425
MAR-TRE-67513f76-92
0.423
ALE-HEI-f28a35b5-14
0.422
CHR-SOS-e960e883-2
0.420
MAR-TRE-4b834d9a-96
0.418
SAN-PRS-52b81272-2
0.415
CHR-SOS-70e4c98a-2
0.415
CHR-SOS-70e4c98a-9
0.415
MAR-TRE-4b834d9a-63
0.415
MAR-TRE-3e4e6814-61
0.412
DUN-NEW-f8ce3686-8
0.412
MAR-TRE-2fd8122f-68
0.410
MAR-TRE-9c797165-60
0.410
CHR-SOS-e960e883-1
0.410
SAD-SAT-24589cd1-4
0.409
MAR-TRE-4b834d9a-31
0.408
SAD-SAT-135344c3-10
0.405
CHR-SOS-70e4c98a-4
0.405
MAK-UNK-a7b37c5e-4
0.403
MAR-TRE-67513f76-93
0.403
BEN-DND-362d364a-10
0.400
KEI-TRE-d5e2018a-45
0.397
MAK-UNK-a7b37c5e-5
0.397
AUS-ARG-7cfdce8f-11
0.397
CHR-SOS-70e4c98a-12
0.395
MAR-TRE-3e4e6814-65
0.395
MAR-TRE-2fd8122f-60
0.395
DAR-DIA-842b4336-16
0.394
FRA-FAC-9ed5a63a-2
0.394
MED-UNK-e6e8ef8a-2
0.394
MAR-TRE-b77b7921-80
0.392
MAR-TRE-d0525fbf-64
0.392
DAR-DIA-842b4336-15
0.392
DAR-DIA-842b4336-10
0.391
SAD-SAT-f25ee457-7
0.390
MAR-TRE-3e4e6814-66
0.390
SAD-SAT-f25ee457-8
0.390
MAR-TRE-2fd8122f-54
0.388
MAR-TRE-9c797165-21
0.388
MAR-TRE-67513f76-55
0.388
MAR-TRE-74c6519b-68
0.388
MAR-TRE-04c86cea-97
0.387
MAK-UNK-c749d764-17
0.386
MAK-UNK-a7b37c5e-1
0.386
FRA-FAC-9ed5a63a-1
0.386
DAR-DIA-23aa0b97-16
0.386
AAR-POS-d2a4d1df-13
0.386
ALE-HEI-f28a35b5-9
0.386
MAR-TRE-2fd8122f-98
0.385
NIM-UNI-02269248-2
0.385
DAR-DIA-842b4336-14
0.384
NIM-UNI-bb610069-1
0.383
NIM-UNI-594fbbb6-1
0.383
KEI-TRE-d5e2018a-68
0.383
DAR-DIA-842b4336-2
0.382
MAK-UNK-d1e89583-1
0.382
DUN-NEW-f8ce3686-4
0.382
MAR-TRE-9c797165-52
0.382
MAR-TRE-2fd8122f-30
0.381
MAR-TRE-4b834d9a-97
0.381
DAR-DIA-842b4336-13
0.380
EDG-MED-0da5ad92-2
0.380
DAR-DIA-842b4336-12
0.380
ALE-HEI-f28a35b5-5
0.380
MED-UNK-e6e8ef8a-5
0.380
MED-UNK-e6e8ef8a-6
0.380
MAR-TRE-2fd8122f-2
0.380
TAM-UNI-c140e31a-10
0.380
ALE-HEI-f28a35b5-15
0.379
MAR-TRE-2fd8122f-57
0.378
CHR-SOS-70e4c98a-6
0.378
MAR-TRE-2fd8122f-43
0.378
MAR-TRE-2fd8122f-49
0.378
MAR-TRE-2fd8122f-47
0.378
MAR-TRE-b77b7921-52
0.378
MAR-TRE-f6f5f473-46
0.378