Molecular Properties | |
SMILES: | Cc1nn(-c2ccccc2)c(Nc2cccc(C(F)(F)F)c2)c1NS(C)(=O)=O |
MW: | 410.1 |
Fraction sp3: | 0.17 |
HBA: | 5 |
HBD: | 2 |
Rotatable Bonds: | 5 |
TPSA: | 76.02 |
cLogP: | 4.31 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Order Status | |
Ordered: | 2020-06-06 |
Synthesis Location: | enamine |
Shipped: | 2020-06-30 |
Hetero_hetero
BEN-VAN-ed886787-17
0.272
LON-WEI-4d77710c-63
0.263
LON-WEI-5e7d1b3e-63
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UNK-CYC-68f84b31-40
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KEI-TRE-d5e2018a-94
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MAR-UCB-195bc32d-32
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MAT-POS-a3f7f96a-4
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MAR-LAB-ff9967db-18
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LON-WEI-5e7d1b3e-23
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LON-WEI-4d77710c-23
0.248
NIL-NON-a189c016-1
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MAT-POS-162a9720-2
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TAT-ENA-80bfd3e5-35
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CHR-GRO-51f79798-1
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UNK-UNK-2ede4078-24
0.238
JAG-UCB-a3ef7265-21
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ERI-UCB-a0b0dbcb-4
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MAR-UCB-195bc32d-35
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UNK-CYC-68f84b31-58
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UNK-CYC-68f84b31-49
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NAU-LAT-f723e322-3
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UNK-CYC-68f84b31-25
0.224
MAT-POS-a3f7f96a-5
0.224
MAK-UNK-9e4a73aa-30
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UNK-CYC-68f84b31-24
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IND-SYN-a2b2ab0e-4
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IND-SYN-5e5c1c3e-4
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JAG-UCB-1d922829-6
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WAR-XCH-b72a1bbc-45
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UNK-CYC-68f84b31-17
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SID-ELM-b654bfa2-5
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DAR-DIA-2964957d-7
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MAK-UNK-6435e6c2-7
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DAR-DIA-0cde14eb-76
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ALP-POS-95b75b4d-3
0.214
JAN-GHE-83b26c96-14
0.214
AAR-POS-0daf6b7e-31
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JOH-UNI-61f30276-4
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AAR-UNI-c25c2f1e-23
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UNK-CYC-68f84b31-32
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LON-WEI-5e7d1b3e-69
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GER-UNI-05c7e912-1
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MAR-LAB-ff9967db-12
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LON-WEI-4d77710c-69
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UNK-CYC-68f84b31-37
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JOH-UNI-abfda500-7
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WIL-UNI-1faa9b10-13
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GIA-UNK-7337c2f3-13
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WIL-UNI-1faa9b10-2
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DAR-DIA-2964957d-5
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MIH-UNI-e573136b-15
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MAK-UNK-1e8f9e3c-1
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MAK-UNK-9159f8ed-6
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LON-WEI-adc59df6-15
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SAD-SAT-2fd372d1-8
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UNK-CYC-68f84b31-34
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UNK-CYC-68f84b31-65
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UNK-CYC-68f84b31-43
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MEL-NAT-8c3652c8-4
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SID-ELM-8b394441-11
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MAK-UNK-9159f8ed-7
0.204
WAR-XCH-b6889685-27
0.202
MAK-UNK-9e4a73aa-29
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MAT-POS-fa06b69f-7
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TAT-ENA-80bfd3e5-45
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UNK-CYC-68f84b31-30
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MAK-UNK-9159f8ed-4
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KEN-MCD-4729dc98-1
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MAR-TRE-fd17a9b8-56
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AUS-ARG-7cfdce8f-12
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MAT-POS-90fd5f68-30
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ROD-UFR-9b69e111-1
0.200
DAR-DIA-093892e4-5
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BRU-UNI-248b30bc-29
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JAN-GHE-4287bd1a-3
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MAK-UNK-9159f8ed-3
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IND-SYN-a2b2ab0e-3
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IND-SYN-5e5c1c3e-3
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KEI-TRE-fa9ada3e-20
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MAK-UNK-9159f8ed-5
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WAR-XCH-b72a1bbc-47
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MAK-UNK-9e4a73aa-1
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MAR-LAB-ff9967db-31
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UNK-CYC-68f84b31-70
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IND-SYN-6c8299e8-2
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ALP-POS-d0876c20-2
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EDJ-MED-c4e42105-3
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WIL-UNI-5578df48-21
0.194
UNK-CYC-68f84b31-41
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MAT-POS-e10a589d-2
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TAT-ENA-80bfd3e5-1
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DAR-DIA-2964957d-8
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RAL-THA-2d450e86-31
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MAK-UNK-9e4a73aa-28
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WIL-UNI-5578df48-19
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WAR-XCH-b6889685-29
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UNK-CYC-68f84b31-62
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UNK-CYC-68f84b31-74
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WAR-XCH-79d12f6e-3
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WIL-UNI-1faa9b10-7
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