symmetric dimethylarginine

symmetric dimethylarginine

CAS: 30344-00-4

Formula: C8H18N4O2

SMILES: CNC(NCCC[C@H](N)C(O)=O)=NC

IUPAC: (2S)-2-amino-5-(N',N''-dimethylcarbamimidamido)pentanoic acid

InChI: InChI=1S/C8H18N4O2/c1-10-8(11-2)12-5-3-4-6(9)7(13)14/h6H,3-5,9H2,1-2H3,(H,13,14)(H2,10,11,12)/t6-/m0/s1

Composition: C (47.51%), H (8.97%), N (27.70%), O (15.82%)

Molar Mass: 202.258

Atom Count: 32

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	0
Asymmetric Atom Count	1
Exact Mass	202.142975836
Formal Charge	0
FSP3	0.75
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
InChIKey	HVPFXCBJHIIJGS-LURJTMIESA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.18
Topological Polar Surface Area	99.74
Polarizability	20.55
Ring Count	0
Rotatable Bond Count	5

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