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28593-08-0 | [1,6]NAPHTHYRIDIN-4-YLAMINE
CAS No: 28593-08-0 Catalog No: AG002VRH MDL No:MFCD01646213
Product Description
Catalog Number:
AG002VRH
Chemical Name:
[1,6]NAPHTHYRIDIN-4-YLAMINE
CAS Number:
28593-08-0
Molecular Formula:
C8H7N3
Molecular Weight:
145.1613
MDL Number:
MFCD01646213
IUPAC Name:
1,6-naphthyridin-4-amine
InChI:
InChI=1S/C8H7N3/c9-7-1-4-11-8-2-3-10-5-6(7)8/h1-5H,(H2,9,11)
InChI Key:
XQOHGKZCTXPHMB-UHFFFAOYSA-N
SMILES:
Nc1ccnc2c1cncc2
Properties
Complexity:
137
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
145.064g/mol
Formal Charge:
0
Heavy Atom Count:
11
Hydrogen Bond Acceptor Count:
3
Hydrogen Bond Donor Count:
1
Isotope Atom Count:
0
Molecular Weight:
145.165g/mol
Monoisotopic Mass:
145.064g/mol
Rotatable Bond Count:
0
Topological Polar Surface Area:
51.8A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.4
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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