AB74497
721-66-4 | 2-(2-Aminoacetamido)-3-phenylpropanoic acid
Manufacturer: A2B Chem
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CatalogNumber
AB74497
ChemicalName
2-(2-Aminoacetamido)-3-phenylpropanoic acid
CasNumber
721-66-4
MolecularFormula
C11H14N2O3
MolecularWeight
222.2405
MdlNumber
MFCD00065109
Smiles
NCC(=O)NC(C(=O)O)Cc1ccccc1
Complexity
250
Covalently-bondedUnitCount
1
HeavyAtomCount
16
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
3
RotatableBondCount
5
UndefinedAtomStereocenterCount
1
Xlogp3
-2.7
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CatalogNumber: AB74497
ChemicalName: 2-(2-Aminoacetamido)-3-phenylpropanoic acid
CasNumber: 721-66-4
MolecularFormula: C11H14N2O3
MolecularWeight: 222.2405
MdlNumber: MFCD00065109
Smiles: NCC(=O)NC(C(=O)O)Cc1ccccc1
Complexity: 250
Covalently-bondedUnitCount: 1
HeavyAtomCount: 16
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 3
RotatableBondCount: 5
UndefinedAtomStereocenterCount: 1
Xlogp3: -2.7
CatalogNumber:
AB74497
ChemicalName:
2-(2-Aminoacetamido)-3-phenylpropanoic acid
CasNumber:
721-66-4
MolecularFormula:
C11H14N2O3
MolecularWeight:
222.2405
MdlNumber:
MFCD00065109
Smiles:
NCC(=O)NC(C(=O)O)Cc1ccccc1
Complexity:
250
Covalently-bondedUnitCount:
1
HeavyAtomCount:
16
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
3
RotatableBondCount:
5
UndefinedAtomStereocenterCount:
1
Xlogp3:
-2.7
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Smiles: OCC(C(=O)O)NC(=O)CN
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RotatableBondCount: __
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Smiles:
OCC(C(=O)O)NC(=O)CN
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__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
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Xlogp3:
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Smiles: NCC(=O)N[C@H](C(=O)O)[C@H](O)C
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCC(=O)N[C@H](C(=O)O)[C@H](O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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MolecularFormula: __
MolecularWeight: __
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Smiles: NCC(=O)NC(C(=O)O)Cc1c[nH]c2c1cccc2
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
NCC(=O)NC(C(=O)O)Cc1c[nH]c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__