Common name
prop-1-ene
IUPAC name
prop-1-ene
SMILES
CC=C
Common name
prop-1-ene
IUPAC name
prop-1-ene
SMILES
CC=C
INCHI
InChI=1S/C3H6/c1-3-2/h3H,1H2,2H3
FORMULA
C3H6
Common name
prop-1-ene
IUPAC name
prop-1-ene
Molecular weight
42.080
clogP
0.442
clogS
-0.470
Frequency
0.0299
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 |
|---|---|---|---|---|
| FDBD02279 | epsilon-metofluthrin |
|
Insecticide | Insecticide |
| FDBD02282 | pentmethrin |
|
Insecticide | Insecticide |
| FDBD02288 | profluthrin |
|
Insecticide | Insecticide |
| FDBD02298 | terallethrin |
|
Insecticide | Insecticide |
| FDBD02351 | allidochlor |
|
Herbicide | Herbicide |
| FDBD02410 | butenachlor |
|
Herbicide | Herbicide |
| FDBD02499 | iodobonil |
|
Herbicide | Herbicide |
| FDBD02522 | ethalfluralin |
|
Herbicide | Herbicide |
| FDBD02525 | methalpropalin |
|
Herbicide | Herbicide |
| FDBD02651 | kuicaoxi |
|
Herbicide | Herbicide |
87 ,
9
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 4wn5_ligand_1_12.mol2 | 4wn5 | 1 | -5.81 | CC=C | 3 |
| 1c29_ligand_1_1.mol2 | 1c29 | 1 | -5.80 | CC=C | 3 |
| 1lfo_ligand_1_6.mol2 | 1lfo | 1 | -5.80 | CC=C | 3 |
| 1vyg_ligand_1_6.mol2 | 1vyg | 1 | -5.80 | C(=C)C | 3 |
| 1vyg_ligand_1_8.mol2 | 1vyg | 1 | -5.80 | C(=C)C | 3 |
| 3a2o_ligand_frag_11.mol2 | 3a2o | 1 | -5.80 | C(=C)C | 3 |
| 3g70_ligand_1_5.mol2 | 3g70 | 1 | -5.79 | CC=C | 3 |
| 4tw6_ligand_1_6.mol2 | 4tw6 | 1 | -5.79 | C(=C)C | 3 |
| 1h3a_ligand_1_0.mol2 | 1h3a | 1 | -5.78 | CC=C | 3 |
| 1o6q_ligand_1_3.mol2 | 1o6q | 1 | -5.78 | CC=C | 3 |
205 ,
21
