L-Lysine, hydrochloride (1:2)

CAS Number: 657-26-1
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NCCCC[C@@H](C(O)=O)N.Cl.Cl
Molecule Information
Mutagenic: none Tumorigenic: none Irritant: none
Formula
HCl.HCl.C6H14N2O2
Molecular Weight
146.189
Drug-likeness
-18.213
CAS
657-26-1
InChI key
JBBURJFZIMRPCZ-XRIGFGBMSA-N
SMILES
NCCCC[C@@H](C(O)=O)N.Cl.Cl
ChemrytIQ

CAS Information Snapshot

1 database item
Mutagenic
none
Tumorigenic
none
Handling Watch
Irritant: none | Reproductive effective: none
PropertyValue
CAS Number 657-26-1
Molecule Name L-Lysine, hydrochloride (1:2)
Molecular Formula HCl.HCl.C6H14N2O2
SMILES NCCCC[C@@H](C(O)=O)N.Cl.Cl
InChI InChI=1S/C6H14N2O2.2ClH/c7-4-2-1-3-5(8)6(9)10;;/h5H,1-4,7-8H2,(H,9,10);2*1H/t5-;;/m0../s1
InChI Key JBBURJFZIMRPCZ-XRIGFGBMSA-N
CanonicalSyTyLFy 62a1920214ce64ae
TotalMolweight 219.111
Molecular Weight 146.189
MonoisotopicMass 146.105528
CLogP -4.6792
CLogS -0.785
H Acceptors 4
H Donors 3
TotalSurfaceArea 122.18
Relative PSA 0.46391
PolarSurfaceArea 89.34
Drug-likeness -18.213
Mutagenic none
Tumorigenic none
Reproductive Effective none
Irritant none
Shape Index 0.8
Molecula Flexibility 0.66203
Molecular Complexity 0.59947
Fragments 3
Non HAtoms 10
NonCHAtoms 4
Electronegative Atoms 4
StereoCenters 1
Rotatable Bond 5
Sp3Atoms 8
Amines 2
AlkylAmines 2
BasicNitrogens 2
AcidicOxygens 1
StereoCon this enantiomer

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