General Information of the Compound
| Compound ID |
CP0043950
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
(S)-methyl 2-amino-5-(amino(nitroamino)methyleneamino)pentanoate
Show/Hide
|
||||||||||||||||||
| Synonyms |
L-NAME
L-Ornithine, N(5)-(imino(nitroamino)methyl)-, methyl ester
Methyl (2S)-2-amino-5-[(amino-nitramido-methylidene)amino]pentanoate
Methyl (2S)-2-amino-5-[[amino(nitramido)methylidene]amino]pentanoate
Methyl N5-(N'-nitrocarbamimidoyl)-L-ornithinate
N(5)-(Imino(nitroamino)methyl)-L-ornithine methyl ester
N(G)-Nitro-L-arginine methyl ester
N(G)-Nitroarginine methyl ester
N(sup G)-Nitro-L-arginine methyl ester
N-.omega.-Nitro-O-arginine methyl ester
N-Nitro-L-arginine methylester
N-Nitroarginine methyl ester
N-omega-Nitro-O-arginine methyl ester
NG-NITROARGININE METHYL ESTER
Ngamma-Nitro-L-arginine methyl ester
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C7H15N5O4
|
||||||||||||||||||
| Molecular Weight |
233.228
|
||||||||||||||||||
| Canonical SMILES |
COC(=O)[C@@H](N)CCCNC(N)=N[N+]([O-])=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C7H15N5O4/c1-16-6(13)5(8)3-2-4-10-7(9)11-12(14)15/h5H,2-4,8H2,1H3,(H3,9,10,11)/t5-/m0/s1
Show/Hide
|
||||||||||||||||||
| InChIKey |
KCWZGJVSDFYRIX-YFKPBYRVSA-N
|
||||||||||||||||||
| CAS |
50903-99-6
|
||||||||||||||||||
| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
| Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
| PubChem ID | |||||||||||||||||||
| ChEMBL ID | |||||||||||||||||||
| DrugBank ID | |||||||||||||||||||
Map of Molecular Bioactivity Related to the Compound
|
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
|---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01856, Nitric oxide synthase 3
Protein ID: PT01718, Nitric oxide synthase, inducible
Protein ID: PT01472, Nitric oxide synthase, inducible
Clinical Information about the Compound