Molecular Properties | |
SMILES: | O=C1c2cccc(O)c2C(=O)c2c(O)cccc21 |
MW: | 240.04 |
Fraction sp3: | 0.0 |
HBA: | 4 |
HBD: | 2 |
Rotatable Bonds: | 0 |
TPSA: | 74.6 |
cLogP: | 1.87 |
Covalent Warhead: | ✗ |
Covalent Fragment: | ✗ |
Source | |
Mcule: | MCULE-5800615690 |
MolPort: | MolPort-000-564-798 |
Quinones, quinone-(di)imines and their thio- and phospho-analogues
N1 Quinones
quinones
Ketone
Dye 4
quinone
quinone_A(370)
MAR-TRE-ebcc4ad6-43
0.605
MAR-UCB-195bc32d-42
0.591
MAR-UCB-195bc32d-49
0.578
MAR-TRE-ebcc4ad6-15
0.578
MAR-UNI-c84db004-12
0.368
MAR-UNI-c84db004-16
0.304
MAR-TRE-fffca54f-12
0.269
MAN-UNK-10ff5583-1
0.269
MAR-UCB-195bc32d-48
0.229
CHE-UNK-3dacc16b-2
0.212
LOR-NEU-c8f11034-1
0.208
ANT-DIA-b7f58f21-3
0.192
LOR-NEU-c8f11034-6
0.189
BEN-DND-03ad4429-5
0.185
JEF-THE-add32b9a-1
0.178
LOR-NEU-c8f11034-2
0.177
RUB-POS-1325a9ea-22
0.176
RAM-UNK-6a5d9687-1
0.176
LOR-NEU-c8f11034-3
0.176
MAR-TRE-ebcc4ad6-30
0.175
JUR-SOU-0920801e-4
0.174
MAR-TRE-fffca54f-81
0.172
MAR-TRE-fffca54f-93
0.172
MAR-UNI-c84db004-6
0.170
DRR-IMP-dff87f5e-4
0.169
MAR-TRE-ebcc4ad6-8
0.169
MAR-TRE-fffca54f-19
0.169
HUB-UNK-9845d277-2
0.169
LOR-NOR-30067bb9-8
0.167
LOR-NOR-30067bb9-12
0.167
MAR-TRE-e86a56b5-11
0.167
MAR-TRE-0fda4e82-26
0.167
TIM-UNK-489d6f60-1
0.167
MAR-TRE-fffca54f-4
0.164
BEN-DND-03ad4429-6
0.164
DOU-UNK-b5326f8f-11
0.164
LOR-NEU-c8f11034-5
0.164
MAK-UNK-10dfa458-4
0.164
BEN-DND-03ad4429-7
0.164
MAK-UNK-c8c8f7e2-19
0.164
CHR-SOS-7098f804-4
0.161
MAK-UNK-10dfa458-26
0.161
ANT-DIA-b7f58f21-2
0.161
WAR-XCH-b72a1bbc-3
0.160
MAK-UNK-53da93bf-5
0.160
LOR-NOR-30067bb9-17
0.159
LOR-NOR-30067bb9-16
0.159
HAO-BIO-c9aafde3-8
0.159
BEN-DND-03ad4429-1
0.158
PRA-UNK-e92af564-1
0.158
JON-UIO-d041ac75-14
0.157
MAR-UNI-c84db004-19
0.157
BRU-UNI-248b30bc-49
0.157
ANT-LOU-17aa1493-1
0.156
DAV-CRI-3edb475e-4
0.155
MAK-UNK-6435e6c2-1
0.155
MAR-TRE-e86a56b5-50
0.154
AAR-POS-0daf6b7e-37
0.154
MAR-TRE-fffca54f-16
0.153
CLI-UNI-032f7715-3
0.153
MAR-TRE-ebcc4ad6-38
0.152
MAR-TRE-fd17a9b8-12
0.152
MAR-TRE-fffca54f-18
0.152
MAR-TRE-fd17a9b8-66
0.152
GIA-UNK-3883fa4f-2
0.152
GUZ-UNI-5a173832-2
0.151
AAR-POS-fca48359-14
0.151
CLI-UNI-032f7715-2
0.151
ROB-UNI-daaf9793-4
0.151
TER-UNK-b9d4d16f-4
0.150
CHR-SOS-7098f804-7
0.150
MAR-TRE-fffca54f-5
0.149
JAR-IMP-dd656357-2
0.149
LON-WEI-4d77710c-3
0.149
JON-UIO-e1edb2d8-1
0.149
MAR-TRE-aca67d11-30
0.149
LON-WEI-5e7d1b3e-3
0.149
NIM-UNI-bb9030bf-14
0.149
HUB-UNK-9845d277-3
0.149
MAR-TRE-ebcc4ad6-25
0.148
NAU-LAT-c9bfe74c-4
0.148
CLI-UNI-032f7715-1
0.148
HUN-WAB-7263dfed-1
0.148
NAU-LAT-ec9c7557-5
0.148
LOR-NOR-30067bb9-13
0.148
MAK-UNK-27459e11-15
0.148
MAK-UNK-c8c8f7e2-8
0.147
NAU-LAT-b0463c38-7
0.147
LOR-NOR-30067bb9-2
0.147
NAU-LAT-356bd3c2-13
0.147
MAK-UNK-c749d764-7
0.147
GIA-UNK-a33ae3bd-1
0.146
SAD-SAT-6b5a89f0-8
0.146
MAR-TRE-e86a56b5-71
0.145
MAK-UNK-27459e11-4
0.145
KTA-UNK-ec872bc6-6
0.145
LON-WEI-4d77710c-19
0.145
AAR-POS-d2a4d1df-22
0.145
LON-WEI-8f408cad-3
0.145
AAR-POS-0daf6b7e-35
0.145