AB54387
37535-51-6 | 3-(2-Pyridyl)-L-alanine
Manufacturer: A2B Chem
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CatalogNumber
AB54387
ChemicalName
3-(2-Pyridyl)-L-alanine
CasNumber
37535-51-6
MolecularFormula
C8H10N2O2
MolecularWeight
166.1772
MdlNumber
MFCD00237827
Smiles
OC(=O)[C@H](Cc1ccccn1)N
Complexity
161
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
12
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
2
RotatableBondCount
3
Xlogp3
-2.4
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CatalogNumber: AB54387
ChemicalName: 3-(2-Pyridyl)-L-alanine
CasNumber: 37535-51-6
MolecularFormula: C8H10N2O2
MolecularWeight: 166.1772
MdlNumber: MFCD00237827
Smiles: OC(=O)[C@H](Cc1ccccn1)N
Complexity: 161
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 12
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 3
Xlogp3: -2.4
CatalogNumber:
AB54387
ChemicalName:
3-(2-Pyridyl)-L-alanine
CasNumber:
37535-51-6
MolecularFormula:
C8H10N2O2
MolecularWeight:
166.1772
MdlNumber:
MFCD00237827
Smiles:
OC(=O)[C@H](Cc1ccccn1)N
Complexity:
161
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
12
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
3
Xlogp3:
-2.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC(=O)CCc1cccc(c1)F
Complexity: __
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC(=O)CCc1cccc(c1)F
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: O=C(c1ccc(cc1)Cl)CCC(=O)O
Complexity: 219
Covalently-bondedUnitCount: __
DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: 2
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C(c1ccc(cc1)Cl)CCC(=O)O
Complexity:
219
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
2
CatalogNumber: AB54390
ChemicalName: 3-(4-Methylbenzoyl)propionic acid
CasNumber: 4619-20-9
MolecularFormula: C11H12O3
MolecularWeight: 192.21118
MdlNumber: MFCD00020541
Smiles: O=C(c1ccc(cc1)C)CCC(=O)O
Complexity: 215
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: __
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 1
RotatableBondCount: 4
Xlogp3: 1.9
CatalogNumber:
AB54390
ChemicalName:
3-(4-Methylbenzoyl)propionic acid
CasNumber:
4619-20-9
MolecularFormula:
C11H12O3
MolecularWeight:
192.21118
MdlNumber:
MFCD00020541
Smiles:
O=C(c1ccc(cc1)C)CCC(=O)O
Complexity:
215
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
1
RotatableBondCount:
4
Xlogp3:
1.9