AA82327
16012-70-7 | Z-Ala-Ala-OH
Manufacturer: A2B Chem
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CatalogNumber
AA82327
ChemicalName
Z-Ala-Ala-OH
CasNumber
16012-70-7
MolecularFormula
C14H18N2O5
MolecularWeight
294.3031
MdlNumber
MFCD00037234
Smiles
C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)OCc1ccccc1
Complexity
380
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
2
HeavyAtomCount
21
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
RotatableBondCount
7
Xlogp3
1.2
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CatalogNumber: AA82327
ChemicalName: Z-Ala-Ala-OH
CasNumber: 16012-70-7
MolecularFormula: C14H18N2O5
MolecularWeight: 294.3031
MdlNumber: MFCD00037234
Smiles: C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)OCc1ccccc1
Complexity: 380
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 2
HeavyAtomCount: 21
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
RotatableBondCount: 7
Xlogp3: 1.2
CatalogNumber:
AA82327
ChemicalName:
Z-Ala-Ala-OH
CasNumber:
16012-70-7
MolecularFormula:
C14H18N2O5
MolecularWeight:
294.3031
MdlNumber:
MFCD00037234
Smiles:
C[C@@H](C(=O)N[C@H](C(=O)O)C)NC(=O)OCc1ccccc1
Complexity:
380
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
2
HeavyAtomCount:
21
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
RotatableBondCount:
7
Xlogp3:
1.2
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: CNC[C@@H](C(=O)O)N.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
CNC[C@@H](C(=O)O)N.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AA82330
ChemicalName: N,N'-Dimethyl-1,4-butanediamine
CasNumber: 16011-97-5
MolecularFormula: C6H16N2
MolecularWeight: 116.20464
MdlNumber: MFCD00039799
Smiles: CNCCCCNC
Complexity: 31.5
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 0.1
CatalogNumber:
AA82330
ChemicalName:
N,N'-Dimethyl-1,4-butanediamine
CasNumber:
16011-97-5
MolecularFormula:
C6H16N2
MolecularWeight:
116.20464
MdlNumber:
MFCD00039799
Smiles:
CNCCCCNC
Complexity:
31.5
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
0.1
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: NC1=NCCCC1.Cl
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NC1=NCCCC1.Cl
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__