Tìm theo
Trans-2-Phenylcyclopropylamine
Thuốc Gốc
Small Molecule
CTHH: C9H12N
PTK: 134.1983
A propylamine formed from the cyclization of the side chain of amphetamine. This monoamine oxidase inhibitor is effective in the treatment of major depression, dysthymic disorder, and atypical depression. It also is useful in panic and phobic disorders. (From AMA Drug Evaluations Annual, 1994, p311)
Nhận Dạng Quốc Tế & Đặc Tính Hóa Học
Công thức hóa học
C9H12N
Phân tử khối
134.1983
Monoisotopic mass
134.096974389
InChI
InChI=1S/C9H11N/c10-9-6-8(9)7-4-2-1-3-5-7/h1-5,8-9H,6,10H2/p+1/t8-,9+/m0/s1
InChI Key
InChIKey=AELCINSCMGFISI-DTWKUNHWSA-O
IUPAC Name
(1R,2S)-2-phenylcyclopropan-1-aminium
Traditional IUPAC Name
(1R,2S)-2-phenylcyclopropan-1-aminium
SMILES
[NH3+][C@@H]1C[C@H]1C1=CC=CC=C1
Độ hòa tan
1.04e-02 g/l
logP
1.34
logS
-4.2
pKa (Strongest Basic)
9.62
PSA
27.64 Å2
Refractivity
52.99 m3·mol-1
Polarizability
15.83 Å3
Rotatable Bond Count
1
H Bond Acceptor Count
0
H Bond Donor Count
1
Physiological Charge
1
Number of Rings
2
Bioavailability
1
Rule of Five
true
Tài Liệu Tham Khảo Thêm
drugbank
http://www.drugbank.ca/drugs/DB02665
PubChem Compound
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=11861988
PubChem Substance
http://pubchem.ncbi.nlm.nih.gov/summary/summary.cgi?sid=46506494
ChemSpider
http://www.chemspider.com/Chemical-Structure.2627899.html
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