Tìm theo
MN-305
Thuốc Gốc
Small Molecule
CTHH: C19H22ClNO5
PTK: 379.835
MN-305 is a novel, potent and highly selective serotonin 5-HT1A receptor agonist under development by MediciNova for the treatment of anxiety disorders beginning with Generalized Anxiety Disorder (GAD).
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C19H22ClNO5
Phân tử khối
379.835
Monoisotopic mass
379.118650526
InChI
InChI=1S/C19H21NO5.ClH/c1-2-5-18-16(4-1)22-12-15(25-18)11-20-8-3-9-21-14-6-7-17-19(10-14)24-13-23-17;/h1-2,4-7,10,15,20H,3,8-9,11-13H2;1H/t15-;/m0./s1
InChI Key
InChIKey=GGNCUSDIUUCNKE-RSAXXLAASA-N
IUPAC Name
[3-(2H-1,3-benzodioxol-5-yloxy)propyl][(2S)-2,3-dihydro-1,4-benzodioxin-2-ylmethyl]amine hydrochloride
Traditional IUPAC Name
[3-(2H-1,3-benzodioxol-5-yloxy)propyl][(2S)-2,3-dihydro-1,4-benzodioxin-2-ylmethyl]amine hydrochloride
SMILES
Cl.C(CNC[C@H]1COC2=CC=CC=C2O1)COC1=CC2=C(OCO2)C=C1
logP
2.51
pKa (Strongest Basic)
9.1
PSA
58.18 Å2
Refractivity
90.59 m3·mol-1
Polarizability
37.06 Å3
Rotatable Bond Count
7
H Bond Acceptor Count
6
H Bond Donor Count
1
Physiological Charge
1
Number of Rings
4
Bioavailability
1
Rule of Five
true
Ghose Filter
true
MDDR-Like Rule
true
Cơ Chế Tác Dụng : MN-305 is a novel, potent and highly selective serotonin 5-HT1A receptor agonist under development by MediciNova for the treatment of anxiety disorders beginning with Generalized Anxiety Disorder (GAD). MN-305 is a potent and highly-selective full agonist at the serotonin 5-HT1A receptor under development by MediciNova both for the treatment of insomnia, as well as for anxiety disorders such as Generalized Anxiety Disorder (GAD). MN-305 has been evaluated in an extensive preclinical toxicology program which showed no evidence of inducing genetic mutations, immune response or cancer. MN-305 has also proved to be consistently well-tolerated in clinical safety, efficacy and pharmacokinetic studies in over 1,200 subjects.
Chỉ Định : Investigated for use/treatment in anxiety disorders, depression, insomnia, and neurologic disorders.
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB05339
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=198746
ChemSpider
http://www.chemspider.com/Chemical-Structure.172022.html
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