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215454-95-8 | 6-(aminomethyl)isoquinolin-1-amine
CAS No: 215454-95-8 Catalog No: AG01FLAO MDL No:MFCD20039973
Product Description
Catalog Number:
AG01FLAO
Chemical Name:
6-(aminomethyl)isoquinolin-1-amine
CAS Number:
215454-95-8
MDL Number:
MFCD20039973
IUPAC Name:
6-(aminomethyl)isoquinolin-1-amine
InChI:
InChI=1S/C10H11N3/c11-6-7-1-2-9-8(5-7)3-4-13-10(9)12/h1-5H,6,11H2,(H2,12,13)
InChI Key:
LWDVTRXNUGVQES-UHFFFAOYSA-N
Properties
Complexity:
172
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
173.095g/mol
Formal Charge:
0
Heavy Atom Count:
13
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
2
Isotope Atom Count:
0
Molecular Weight:
173.219g/mol
Monoisotopic Mass:
173.095g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
64.9A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.8
Literature
| Title | Journal |
|---|---|
| Fragment-based discovery of 6-substituted isoquinolin-1-amine based ROCK-I inhibitors. | Bioorganic & medicinal chemistry letters 20110101 |
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