AB75248
4299-69-8 | (S)-Benzyl 2-amino-3-(1H-indol-3-yl)propanoate
Manufacturer: A2B Chem
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CatalogNumber
AB75248
ChemicalName
(S)-Benzyl 2-amino-3-(1H-indol-3-yl)propanoate
CasNumber
4299-69-8
MolecularFormula
C18H18N2O2
MolecularWeight
294.3477200000001
MdlNumber
MFCD02683457
Smiles
N[C@H](C(=O)OCc1ccccc1)Cc1c[nH]c2c1cccc2
Complexity
368
Covalently-bondedUnitCount
1
DefinedAtomStereocenterCount
1
HeavyAtomCount
22
HydrogenBondAcceptorCount
3
HydrogenBondDonorCount
2
RotatableBondCount
6
Xlogp3
3
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CatalogNumber: AB75248
ChemicalName: (S)-Benzyl 2-amino-3-(1H-indol-3-yl)propanoate
CasNumber: 4299-69-8
MolecularFormula: C18H18N2O2
MolecularWeight: 294.3477200000001
MdlNumber: MFCD02683457
Smiles: N[C@H](C(=O)OCc1ccccc1)Cc1c[nH]c2c1cccc2
Complexity: 368
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 22
HydrogenBondAcceptorCount: 3
HydrogenBondDonorCount: 2
RotatableBondCount: 6
Xlogp3: 3
CatalogNumber:
AB75248
ChemicalName:
(S)-Benzyl 2-amino-3-(1H-indol-3-yl)propanoate
CasNumber:
4299-69-8
MolecularFormula:
C18H18N2O2
MolecularWeight:
294.3477200000001
MdlNumber:
MFCD02683457
Smiles:
N[C@H](C(=O)OCc1ccccc1)Cc1c[nH]c2c1cccc2
Complexity:
368
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
22
HydrogenBondAcceptorCount:
3
HydrogenBondDonorCount:
2
RotatableBondCount:
6
Xlogp3:
3
CatalogNumber: AB75249
ChemicalName: L-Tyrosine ethyl ester
CasNumber: 949-67-7
MolecularFormula: C11H15NO3
MolecularWeight: 209.2417
MdlNumber: MFCD00063046
Smiles: CCOC(=O)[C@H](Cc1ccc(cc1)O)N
Complexity: 200
Covalently-bondedUnitCount: 1
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 2
RotatableBondCount: 5
Xlogp3: 0.6
CatalogNumber:
AB75249
ChemicalName:
L-Tyrosine ethyl ester
CasNumber:
949-67-7
MolecularFormula:
C11H15NO3
MolecularWeight:
209.2417
MdlNumber:
MFCD00063046
Smiles:
CCOC(=O)[C@H](Cc1ccc(cc1)O)N
Complexity:
200
Covalently-bondedUnitCount:
1
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
2
RotatableBondCount:
5
Xlogp3:
0.6
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Smiles: NNC(=O)[C@H](Cc1ccc(cc1)O)N
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Smiles:
NNC(=O)[C@H](Cc1ccc(cc1)O)N
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HeavyAtomCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CC(=O)Oc1ccc(cc1)C[C@@H](C(=O)O)N
Complexity: __
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DefinedAtomStereocenterCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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__
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CasNumber:
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MolecularFormula:
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MolecularWeight:
__
MdlNumber:
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Smiles:
CC(=O)Oc1ccc(cc1)C[C@@H](C(=O)O)N
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
__
RotatableBondCount:
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Xlogp3:
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