AD21645
486424-37-7 | 3-Amino-6-bromopyrazine-2-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AD21645
ChemicalName
3-Amino-6-bromopyrazine-2-carboxylic acid
CasNumber
486424-37-7
MolecularFormula
C5H4BrN3O2
MolecularWeight
218.0082
MdlNumber
MFCD08275681
Smiles
Brc1cnc(c(n1)C(=O)O)N
Complexity
166
Covalently-bondedUnitCount
1
HeavyAtomCount
11
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
2
RotatableBondCount
1
Xlogp3
0.9
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CatalogNumber: AD21645
ChemicalName: 3-Amino-6-bromopyrazine-2-carboxylic acid
CasNumber: 486424-37-7
MolecularFormula: C5H4BrN3O2
MolecularWeight: 218.0082
MdlNumber: MFCD08275681
Smiles: Brc1cnc(c(n1)C(=O)O)N
Complexity: 166
Covalently-bondedUnitCount: 1
HeavyAtomCount: 11
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 2
RotatableBondCount: 1
Xlogp3: 0.9
CatalogNumber:
AD21645
ChemicalName:
3-Amino-6-bromopyrazine-2-carboxylic acid
CasNumber:
486424-37-7
MolecularFormula:
C5H4BrN3O2
MolecularWeight:
218.0082
MdlNumber:
MFCD08275681
Smiles:
Brc1cnc(c(n1)C(=O)O)N
Complexity:
166
Covalently-bondedUnitCount:
1
HeavyAtomCount:
11
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
2
RotatableBondCount:
1
Xlogp3:
0.9
CatalogNumber: AD21646
ChemicalName: (1-Methyl-1h-imidazol-4-yl)methylamine
CasNumber: 486414-83-9
MolecularFormula: C5H9N3
MolecularWeight: 111.1451
MdlNumber: MFCD06411536
Smiles: Cn1cc(nc1)CN
Complexity: 74.1
Covalently-bondedUnitCount: 1
HeavyAtomCount: 8
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: -1.1
CatalogNumber:
AD21646
ChemicalName:
(1-Methyl-1h-imidazol-4-yl)methylamine
CasNumber:
486414-83-9
MolecularFormula:
C5H9N3
MolecularWeight:
111.1451
MdlNumber:
MFCD06411536
Smiles:
Cn1cc(nc1)CN
Complexity:
74.1
Covalently-bondedUnitCount:
1
HeavyAtomCount:
8
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
-1.1
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CasNumber: __
MolecularFormula: __
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Smiles: OC(=O)C[C@@H](c1ccccc1Cl)NC(=O)OC(C)(C)C
Complexity: __
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Smiles:
OC(=O)C[C@@H](c1ccccc1Cl)NC(=O)OC(C)(C)C
Complexity:
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HeavyAtomCount:
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Smiles: CCN1CCC(CC1)(N)C(=O)O
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Smiles:
CCN1CCC(CC1)(N)C(=O)O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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