Molecular Properties | |
SMILES: | Cc1nc(C)c(S(=O)(=O)NCC2CCCC3CC23)s1 |
MW: | 300.1 |
Fraction sp3: | 0.77 |
HBA: | 4 |
HBD: | 1 |
Rotatable Bonds: | 4 |
TPSA: | 59.06 |
cLogP: | 2.47 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Activity Data | |
IC50 (µM) - Fluorescence: | 99.5 |
Order Status | |
Shipped: | 2021-04-29 |
Hetero_hetero
SCO-VAN-260d9628-2
0.214
ASH-UNK-40b46b30-2
0.209
MAR-TRE-ebcc4ad6-20
0.196
MAR-TRE-aca67d11-91
0.186
MAK-UNK-c749d764-33
0.183
MAK-UNK-c749d764-1
0.178
WIL-LEE-1f71e281-2
0.178
MAK-UNK-8145c7a0-4
0.178
MAR-TRE-8190bb11-94
0.177
JAR-KUA-41bd5a3d-4
0.176
ALP-POS-347519b5-2
0.175
MAR-TRE-6c5ef77a-97
0.174
YOI-UNK-12211982-2
0.174
YOI-UNK-a533afbc-2
0.174
MAK-UNK-c749d764-16
0.173
JON-UNI-2a110085-2
0.172
VIK-SYN-9a3d118a-5
0.171
MAK-UNK-c749d764-8
0.170
MAK-UNK-c749d764-2
0.170
MAK-UNK-8145c7a0-6
0.170
MAK-UNK-c749d764-4
0.168
MAK-UNK-c749d764-25
0.168
SAG-UNI-75aa781c-2
0.168
MAR-TRE-fd17a9b8-25
0.168
JON-UNI-2a110085-4
0.167
BRU-UNI-248b30bc-5
0.165
JAC-SHE-fb00f511-1
0.165
FRA-DIA-3f9ae552-2
0.165
NJA-MAN-b8640440-1
0.165
NJA-MAN-b9fb953f-10
0.165
MAR-TRE-6a44bbf2-24
0.163
MAK-UNK-1cb0e944-10
0.162
SAG-UNI-75aa781c-3
0.161
CHA-KIN-cd2ef30b-1
0.161
MAK-UNK-c749d764-19
0.160
MAK-UNK-c749d764-24
0.160
KUS-THE-322b9b63-21
0.160
MAK-UNK-8145c7a0-3
0.160
MAR-TRE-4b834d9a-88
0.160
MAT-POS-b5746674-33
0.160
MAK-UNK-c749d764-15
0.160
SIM-DEM-5935bd74-5
0.160
JON-UIO-0c651a4b-1
0.159
UNK-CYC-68f84b31-7
0.159
MAK-UNK-c749d764-10
0.159
MAK-UNK-ffc90da7-2
0.158
MAR-TRE-fd17a9b8-8
0.158
MAR-TRE-f5c2d31c-68
0.158
MAK-UNK-c749d764-12
0.158
SAD-SAT-cefd50cc-3
0.158
CHA-KIN-f512e507-3
0.157
MAK-UNK-c749d764-31
0.157
MAK-UNK-c749d764-29
0.157
MAK-UNK-8145c7a0-7
0.157
ANT-DIA-b7f58f21-6
0.157
MAR-TRE-ebcc4ad6-47
0.157
ALP-POS-347519b5-1
0.156
MAK-UNK-c749d764-20
0.156
MAR-TRE-aca67d11-13
0.155
VIJ-CYC-1a381570-13
0.155
MAR-TRE-36bf7dba-16
0.155
MAK-UNK-7264f48c-6
0.154
ABI-SAT-aa268ad7-11
0.154
MAK-UNK-c749d764-3
0.154
MAT-POS-b5746674-32
0.153
MAK-UNK-c749d764-28
0.152
UNK-CYC-68f84b31-1
0.152
MAR-TRE-fd17a9b8-40
0.152
MAK-UNK-7264f48c-3
0.152
KUS-THE-322b9b63-22
0.152
MAR-TRE-3159af1a-63
0.152
MAK-UNK-c749d764-5
0.152
RAF-POL-950dada1-24
0.152
KUS-THE-322b9b63-5
0.152
ALI-DIA-59c2fdb0-4
0.152
MAK-UNK-c749d764-18
0.152
MAK-UNK-c749d764-21
0.152
WIL-UNI-2a57d06c-26
0.152
JON-UNI-2a110085-1
0.151
MAK-UNK-8145c7a0-5
0.151
MAR-TRE-92684b97-39
0.151
BEN-DND-6de5dfa0-3
0.151
NAU-LAT-3f5f3993-5
0.151
BEN-DND-09b88bf4-3
0.151
DAV-IMP-59dd6621-5
0.151
ALI-DIA-59c2fdb0-1
0.150
MAR-TRE-d0525fbf-10
0.150
JON-UIO-f971c856-7
0.150
MAR-TRE-be9ff7d2-8
0.150
EDJ-MED-41558c53-7
0.150
MAR-TRE-92684b97-33
0.150
MAK-UNK-6435e6c2-10
0.150
MAK-UNK-4c6b313a-1
0.150
SCO-VAN-260d9628-7
0.150
MAK-UNK-6435e6c2-11
0.150
MAR-TRE-4b834d9a-86
0.150
MAT-POS-b5746674-21
0.150
DOU-UNK-b5326f8f-6
0.150
SAD-SAT-5b1897b2-2
0.149
SAG-UNI-75aa781c-1
0.149