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Profil Sekolah - Kampus
Dokumen 123
JWH-424
JWH-424
Klinički podaci
Drugs.com
Monografija
Identifikatori
ATC kod
None
Hemijski podaci
Formula
C
24
H
22
Br
N
O
Molarna masa
420,342
SMILES
CCCCCn1cc(C(=O)c2cccc3cccc(Br)c23)c4ccccc14
InChI
InChI=1S/C24H22BrNO/c1-2-3-6-15-26-16-20(18-11-4-5-14-22(18)26)24(27)19-12-7-9-17-10-8-13-21(25)23(17)19/h4-5,7-14,16H,2-3,6,15H2,1H3
Y
Key:QXZYVJRMQVOOEQ-UHFFFAOYSA-N
Y
JWH-424
je
organsko jedinjenje
, koje sadrži 24
atoma
ugljenika
i ima
molekulsku masu
od 420,342
Da
.
Osobine
Osobina
Vrednost
Broj akceptora vodonika
1
Broj donora vodonika
0
Broj rotacionih veza
6
Particioni koeficijent
[
1
]
(
ALogP
)
7,2
Rastvorljivost
[
2
]
(
logS
, log(
mol/L
))
-9,6
Polarna površina
[
3
]
(
PSA
,
Å
2
)
22,0
Reference
^
Ghose, A.K.; Viswanadhan V.N. & Wendoloski, J.J. (1998).
„Prediction of Hydrophobic (Lipophilic) Properties of Small Organic Molecules Using Fragment Methods: An Analysis of AlogP and CLogP Methods”
.
J. Phys. Chem. A
.
102
: 3762—3772.
doi
:
10.1021/jp980230o
.
^
Tetko IV, Tanchuk VY, Kasheva TN, Villa AE (2001).
„Estimation of Aqueous Solubility of Chemical Compounds Using E-State Indices”
.
Chem Inf. Comput. Sci
.
41
: 1488—1493.
PMID
11749573
.
doi
:
10.1021/ci000392t
.
^
Ertl P.; Rohde B.; Selzer P. (2000).
„Fast calculation of molecular polar surface area as a sum of fragment based contributions and its application to the prediction of drug transport properties”
.
J. Med. Chem
.
43
: 3714—3717.
PMID
11020286
.
doi
:
10.1021/jm000942e
.
Literatura
Hardman JG, Limbird LE, Gilman AG (2001).
Goodman & Gilman's The Pharmacological Basis of Therapeutics
(10. изд.). New York: McGraw-Hill.
ISBN
0071354697
.
doi
:
10.1036/0071422803
.
Thomas L. Lemke; David A. Williams, ур. (2007).
Foye's Principles of Medicinal Chemistry
(6. изд.). Baltimore: Lippincott Willams & Wilkins.
ISBN
0781768799
.
Spoljašnje veze
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JWH-424
на
Викимедијиној остави
.
JWH-424