Common name
2-methylprop-1-ene
IUPAC name
2-methylprop-1-ene
SMILES
C=C(C)C
Common name
2-methylprop-1-ene
IUPAC name
2-methylprop-1-ene
SMILES
C=C(C)C
INCHI
InChI=1S/C4H8/c1-4(2)3/h1H2,2-3H3
FORMULA
C4H8
Common name
2-methylprop-1-ene
IUPAC name
2-methylprop-1-ene
Molecular weight
56.106
clogP
0.730
clogS
-0.913
Frequency
0.0131
HBond Acceptor
0
HBond Donor
0
Total PolarSurface Area
0
Number of Rings
0
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00517 | Pentazocine |
|
Analgesics; Analgesics, Opioid; Narcotics; Adjuvants, Anesthesia; Narcotic Antagonists; Nervous System; Opioids; Benzomorphan Derivatives; | For the relief of moderate to severe pain. |
| FDBD00553 | Mycophenolate mofetil |
|
Immunosuppressive Agents; Cytochrome P-450 CYP2C8 Inhibitors; Cytochrome P-450 CYP2C8 Inducers; CYP3A4 Inhibitors; | For the prophylaxis of organ rejection in patients receiving allogeneic renal, cardiac or hepatic transplants. Mycophenolate mofetil should be used concomitantly with cyclosporine and corticosteroids. |
| FDBD00876 | Phylloquinone |
|
Vitamins; Antifibrinolytic Agents; Vitamin K; Blood and Blood Forming Organs; Antihemorrhagics; | For the treatment of haemorrhagic conditions in infants, antidote for coumarin anticoagulants in hypoprothrombinaemia. |
| FDBD00878 | Mycophenolic acid |
|
Immunosuppressive Agents; Enzyme Inhibitors; Antibiotics, Antineoplastic; Antineoplastic and Immunomodulating Agents; Selective Immunosuppressants; | For the prophylaxis of organ rejection in patients receiving allogeneic renal transplants, administered in combination with cyclosporine and corticosteroids. |
| FDBD00903 | Novobiocin |
|
Enzyme Inhibitors; Anti-Bacterial Agents; Nucleic Acid Synthesis Inhibitors; Antibacterials for Systemic Use; Antiinfectives for Systemic Use; BSEP/ABCB11 Inhibitors; | For the treatment of infections due to staphylococci and other susceptible organisms. |
| FDBD01291 | Fusidic Acid |
|
Anti-Bacterial Agents; Protein Synthesis Inhibitors; Antibiotics; Ophthalmologicals; Sensory Organs; Antibacterials for Systemic Use; Antiinfectives for Systemic Use; Dermatologicals; Antiinfectives; Medicated Dressings With Antiinfectives; Medicated Dressings; Antibiotics for Topical Use; Steroid Antibacterials; BSEP/ABCB11 Inhibitors; | For the treatment of bacterial infections. |
| FDBD01446 | Isometheptene |
|
Alimentary Tract and Metabolism; Drugs for Functional Gastrointestinal Disorders; | Isometheptene is a sympathomimetic drug which causes vasoconstriction. It is used for treating migraines and tension headaches. |
| FDBD01854 | cinerins |
|
Insecticide | Insecticide |
| FDBD01855 | cinerin I |
|
Insecticide | Insecticide |
| FDBD01857 | jasmolin I |
|
Insecticide | Insecticide |
38 ,
4
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1tvr_ligand_frag_2.mol2 | 1tvr | 1 | -6.26 | C=C(C)C | 4 |
| 1rev_ligand_frag_2.mol2 | 1rev | 1 | -6.22 | C=C(C)C | 4 |
| 4tq3_ligand_frag_5.mol2 | 4tq3 | 1 | -6.17 | C=C(C)C | 4 |
| 3hkw_ligand_1_3.mol2 | 3hkw | 1 | -6.11 | C=C(C)C | 4 |
| 1uwb_ligand_frag_2.mol2 | 1uwb | 1 | -6.08 | C=C(C)C | 4 |
| 3hky_ligand_1_3.mol2 | 3hky | 1 | -6.08 | C=C(C)C | 4 |
| 4ea2_ligand_frag_0.mol2 | 4ea2 | 1 | -6.05 | C=C(C)C | 4 |
207 ,
21
