AB45989
870-93-9 | Dl-homocystine
Manufacturer: A2B Chem
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CatalogNumber
AB45989
ChemicalName
Dl-homocystine
CasNumber
870-93-9
MolecularFormula
C8H16N2O4S2
MolecularWeight
268.3536
MdlNumber
MFCD00069587
Smiles
NC(C(=O)O)CCSSCCC(C(=O)O)N
Complexity
216
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
8
HydrogenBondDonorCount
4
RotatableBondCount
9
UndefinedAtomStereocenterCount
2
Xlogp3
-5.6
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CatalogNumber: AB45989
ChemicalName: Dl-homocystine
CasNumber: 870-93-9
MolecularFormula: C8H16N2O4S2
MolecularWeight: 268.3536
MdlNumber: MFCD00069587
Smiles: NC(C(=O)O)CCSSCCC(C(=O)O)N
Complexity: 216
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 8
HydrogenBondDonorCount: 4
RotatableBondCount: 9
UndefinedAtomStereocenterCount: 2
Xlogp3: -5.6
CatalogNumber:
AB45989
ChemicalName:
Dl-homocystine
CasNumber:
870-93-9
MolecularFormula:
C8H16N2O4S2
MolecularWeight:
268.3536
MdlNumber:
MFCD00069587
Smiles:
NC(C(=O)O)CCSSCCC(C(=O)O)N
Complexity:
216
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
8
HydrogenBondDonorCount:
4
RotatableBondCount:
9
UndefinedAtomStereocenterCount:
2
Xlogp3:
-5.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CC1OC(=O)C(OC1=O)C
Complexity: 155
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: 0.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CC1OC(=O)C(OC1=O)C
Complexity:
155
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
0.6
CatalogNumber: AB45991
ChemicalName: Dl-lysine monohydrate
CasNumber: 885701-25-7
MolecularFormula: C6H16N2O3
MolecularWeight: 164.2028
MdlNumber: MFCD00151036
Smiles: NCCCCC(C(=O)O)N.O
Complexity: 106
Covalently-bondedUnitCount: 2
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 4
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: __
CatalogNumber:
AB45991
ChemicalName:
Dl-lysine monohydrate
CasNumber:
885701-25-7
MolecularFormula:
C6H16N2O3
MolecularWeight:
164.2028
MdlNumber:
MFCD00151036
Smiles:
NCCCCC(C(=O)O)N.O
Complexity:
106
Covalently-bondedUnitCount:
2
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
4
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CSCCC(C(=O)O)N
Complexity: 97
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: -1.9
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CSCCC(C(=O)O)N
Complexity:
97
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
-1.9