Compound Summary
Ro 41-0960
Compound Information
Ro 41-0960
Compound Name: | Ro 41-0960 |
Compound CID: | 3495594 |
Synonyms: | Ro 41-0960 125628-97-9 2-fluoro-3,4-dihydroxy-5-nitrobenzophenone (3,4-Dihydroxy-5-nitrophenyl)(2-fluorophenyl)methanone Ro41-0960 More... |
Iupac Name: | (3,4-dihydroxy-5-nitrophenyl)-(2-fluorophenyl)methanone |
InChI: | InChI=1S/C13H8FNO5/c14-9-4-2-1-3-8(9)12(17)7-5-10(15(19)20)13(18)11(16)6-7/h1-6,16,18H |
InChIKey: | RQPAUNZYTYHKHA-UHFFFAOYSA-N |
Canonical Smiles: | C1=CC=C(C(=C1)C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])F |
Isomeric Smiles: | C1=CC=C(C(=C1)C(=O)C2=CC(=C(C(=C2)O)O)[N+](=O)[O-])F |
Molecular Weight: | 277.2 |
Molecular Formula: | C13H8FNO5 |
Compound Structure
2D Structure:
3D Structure:
Computed Properties
Ro 41-0960
Molecular Weight: | 277.2 |
Molecular Formula: | C13H8FNO5 |
Hydrogen Bond Donor Count: | 2 |
Hydrogen Bond Acceptor Count: | 6 |
Rotatable Bond Count: | 2 |
Heavy Atom Count: | 20 |
Complexity: | 385 |
Synonyms
Ro 41-0960
| Ro 41-0960 | Ro 41-0960 |
|---|---|
Ro 41-0960 |
125628-97-9 |
2-fluoro-3,4-dihydroxy-5-nitrobenzophenone |
(3,4-Dihydroxy-5-nitrophenyl)(2-fluorophenyl)methanone |
Ro41-0960 |
Ro-41-0960 |
UNII-SXV6U29ZOI |
SXV6U29ZOI |
MLS002153480 |
RO 41-0960 COMT IHIBITOR |
SMR000326831 |
OR 1139 |
SR-01000075645 |
OR-1139 |
3p3r |
Lopac-R-108 |
Lopac0_001044 |
Ro 41-0960, solid |
SCHEMBL6036458 |
(3,4-dihydroxy-5-nitrophenyl)-(2-fluorophenyl)methanone |
CHEMBL1256291 |
AOB5064 |
DTXSID20154812 |
BDBM138363 |
HMS2234A07 |
HMS3263A10 |
HMS3371P20 |
Methanone, (3,4-dihydroxy-5-nitrophenyl)(2-fluorophenyl)- |
Tox21_501044 |
MFCD00078597 |
ZINC36384898 |
AKOS024418847 |
RO 41-0960 COMT INHIBITOR |
CCG-205121 |
LP01044 |
MCULE-5815188503 |
Ro-410960 |
SDCCGSBI-0051014.P002 |
NCGC00015881-01 |
NCGC00015881-02 |
NCGC00015881-03 |
NCGC00015881-04 |
NCGC00015881-07 |
NCGC00094329-01 |
NCGC00094329-02 |
NCGC00261729-01 |
EU-0101044 |
R-108 |
US8877795, Ro 41-0960 |
SR-01000075645-2 |
SR-01000075645-6 |
SR-01000075645-7 |
Q27453915 |
(3,4-dihydroxy-5-nitrophenyl)(2-fluorophenyl)-Methanone |
3M1 |
Experimental Data
Ro 41-0960
| Species | Dose | Unit | Control(Avg days) | Treatment(Avg days) | Avg/Med Lifespan Change(%) | Control(Max days) | Treatment(Max days) | Max Lifespan Change(%) | Significant | Strain | Gender | PubMed | Avg/Med Lifespan Change tab |
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Caenorhabditis elegans | 33.000000000000000 | umol/L | 3.000000000000000 | NS | N2 | 24134630 | Inactive |
Experimental Data Visualization
Ro 41-0960
Statistics Data
Ro 41-0960
| Species | Avg/Med Lifespan Change(%) | Max Lifespan Change(%) | Count Reference | Count Data point |
|---|---|---|---|---|
| Caenorhabditis elegans | 3.000000000000000 | 1 | 1 |
Statistics Data Visualization
Ro 41-0960
