Methylarginine | SBID = 1013 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 114.0 | ||
| Ertl TPSA/Å2: | |||
| Hydrophilicity (PubChem XLogP): | -4.1 | ||
| Hydrophilicity (Cheng XLogP3): | |||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 4.0 | ||
| Number of H-Bond Acceptors: | 4.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 1.0 | ||
| 3D Volume/Å3: | 146.3 | ||
| Sum Formula: | C7H16N4O2 | ||
| M / g/mol: | 188.23 | ||
| Complexity: | 193.0 | ||
| Number of Conformers: | 10.0 |
Identifiers
- Tags: aminoacid derivative
- Name: Methylarginine
- Preferred Abbreviation: Methylarginine
- IUPAC Name: 2-amino-5-[(N'-methylcarbamimidoyl)amino]pentanoic acid
- CAS:
- CID: 4366
- InChiKey: NTNWOCRCBQPEKQ-UHFFFAOYSA-N
- InChi: InChI=1S/C7H16N4O2/c1-10-7(9)11-4-2-3-5(8)6(12)13/h5H,2-4,8H2,1H3,(H,12,13)(H3,9,10,11)
- CanoSmiles: CN=C(N)NCCCC(C(=O)O)N
- IsoSmiles: CN=C(N)NCCCC(C(=O)O)N
