Common name
1,4-dihydronaphthalen-2-ol
IUPAC name
1,4-dihydronaphthalen-2-ol
SMILES
OC1=CCc2c(cccc2)C1
Common name
1,4-dihydronaphthalen-2-ol
IUPAC name
1,4-dihydronaphthalen-2-ol
SMILES
OC1=CCc2c(cccc2)C1
INCHI
InChI=1S/C10H10O/c11-10-6-5-8-3-1-2-4-9(8)7-10/h1-4,6,11H,5,7H2
FORMULA
C10H10O
Common name
1,4-dihydronaphthalen-2-ol
IUPAC name
1,4-dihydronaphthalen-2-ol
Molecular weight
146.186
clogP
2.461
clogS
-2.055
Frequency
0.0003
HBond Acceptor
1
HBond Donor
1
Total PolarSurface Area
20.23
Number of Rings
2
Rotatable Bond
0
| Drug ID | Common name | Structure CAS | Compound class | Therapeutic area |
|---|---|---|---|---|
| FDBD00394 | Tolnaftate |
|
Antifungal Agents; Dermatologicals; Antifungals for Topical Use; Antifungals for Dermatological Use; | Tolnaftate topical is used to treat skin infections such as athlete's foot, jock itch, and ringworm infections. Tolnaftate is also used, along with other antifungals, to treat infections of the nails, scalp, palms, and soles of the feet. The powder and powder aerosol may be used to prevent athlete's foot. |
1 ,
1
| FRAGNAME | PDBID | SIMILIRITY | XSCORE | SMILE | HAC |
|---|---|---|---|---|---|
| 1i33_ligand_1_4.mol2 | 1i33 | 0.684211 | -6.66 | [NH3+][C@H]1c2ccccc2CC=C1 | 11 |
| 4g0k_ligand_frag_3.mol2 | 4g0k | 0.619048 | -6.46 | O=C1c2c(C(=O)C=C1C)cccc2 | 13 |
| 1nny_ligand_3_85.mol2 | 1nny | 0.602273 | -6.73 | C(CC(=O)N)[C@H]1C=CCc2c1cccc2 | 15 |
| 4g55_ligand_1_0.mol2 | 4g55 | 0.590909 | -7.59 | [S](O)(O)c1c2CC=CCc2ccc1 | 13 |
| 3b7j_ligand_frag_0.mol2 | 3b7j | 0.582418 | -6.95 | O=C1C=CC(=O)c2c1cccc2O | 13 |
| 3b7j_ligand.mol2 | 3b7j | 0.582418 | -6.95 | O=C1C=CC(=O)c2c1cccc2O | 14 |
| 1nny_ligand_4_301.mol2 | 1nny | 0.56383 | -6.79 | C(=O)(NC)CC[C@H]1C=CCc2c1cccc2 | 16 |
| 1nny_ligand_3_77.mol2 | 1nny | 0.557895 | -6.90 | C(CNC(=O)C)[C@H]1C=CCc2c1cccc2 | 16 |
110 ,
12
