L-Ornithine monohydrochloride

CAS Number: 3184-13-2
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NCCC[C@@H](C(O)=O)N.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.C5H12N2O2
Molecular Weight
132.162
Drug-likeness
-14.031
CAS
3184-13-2
InChI key
GGTYBZJRPHEQDG-WCCKRBBISA-N
SMILES
NCCC[C@@H](C(O)=O)N.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 3184-13-2
Molecule Name L-Ornithine monohydrochloride
Molecular Formula HCl.C5H12N2O2
SMILES NCCC[C@@H](C(O)=O)N.Cl
InChI InChI=1S/C5H12N2O2.ClH/c6-3-1-2-4(7)5(8)9;/h4H,1-3,6-7H2,(H,8,9);1H/t4-;/m0./s1
InChI Key GGTYBZJRPHEQDG-WCCKRBBISA-N
CanonicalSyTyLFy c144a352cda9d146
TotalMolweight 168.623
Molecular Weight 132.162
MonoisotopicMass 132.089878
CLogP -5.1336
CLogS -0.515
H Acceptors 4
H Donors 3
TotalSurfaceArea 108.42
Relative PSA 0.52278
PolarSurfaceArea 89.34
Drug-likeness -14.031
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.77778
Molecula Flexibility 0.69361
Molecular Complexity 0.57565
Fragments 2
Non HAtoms 9
NonCHAtoms 4
Electronegative Atoms 4
StereoCenters 1
Rotatable Bond 4
Sp3Atoms 7
Amines 2
AlkylAmines 2
BasicNitrogens 2
AcidicOxygens 1
StereoCon this enantiomer

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