Dasotraline HydrochlorideProduct ingredient for Dasotraline
- Name
- Dasotraline Hydrochloride
- Drug Entry
- Dasotraline
Dasotraline is a serotonin, norepinephrine and dopamine reuptake inhibitor (SNDRI) that is under investigation for the treatment of Binge Eating Disorder, Adult Attention Hyperactivity Disorder, Attention Deficit Hyperactivity Disorder, and Adult Attention Deficit Hyperactivity Disorder.
- Accession Number
- DBSALT002174
- Structure
- Synonyms
- Not Available
- UNII
- 1VIY7J4C0I
- CAS Number
- 675126-08-6
- Weight
- Average: 328.66
Monoisotopic: 327.0348326 - Chemical Formula
- C16H16Cl3N
- InChI Key
- YKXHIERZIRLOLD-DFIJPDEKSA-N
- InChI
- InChI=1S/C16H15Cl2N.ClH/c17-14-7-5-10(9-15(14)18)11-6-8-16(19)13-4-2-1-3-12(11)13;/h1-5,7,9,11,16H,6,8,19H2;1H/t11-,16+;/m0./s1
- IUPAC Name
- (1R,4S)-4-(3,4-dichlorophenyl)-1,2,3,4-tetrahydronaphthalen-1-amine hydrochloride
- SMILES
- Cl.N[C@@H]1CC[C@@H](C2=CC=C(Cl)C(Cl)=C2)C2=CC=CC=C12
- External Links
- ChemSpider
- 23976010
- ChEMBL
- CHEMBL3301596
- Predicted Properties
Property Value Source Water Solubility 9.79e-05 mg/mL ALOGPS logP 4.92 ALOGPS logP 4.72 Chemaxon logS -6.5 ALOGPS pKa (Strongest Basic) 9.52 Chemaxon Physiological Charge 1 Chemaxon Hydrogen Acceptor Count 1 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 26.02 Å2 Chemaxon Rotatable Bond Count 1 Chemaxon Refractivity 80.97 m3·mol-1 Chemaxon Polarizability 30.29 Å3 Chemaxon Number of Rings 3 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter Yes Chemaxon Veber's Rule Yes Chemaxon MDDR-like Rule No Chemaxon