AC80886
937795-91-0 | [1-(6-Methylpyrazin-2-yl)piperid-3-yl]methanol
Manufacturer: A2B Chem
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CatalogNumber
AC80886
ChemicalName
[1-(6-Methylpyrazin-2-yl)piperid-3-yl]methanol
CasNumber
937795-91-0
MolecularFormula
C11H17N3O
MolecularWeight
207.2722
MdlNumber
MFCD09879916
Smiles
OCC1CCCN(C1)c1cncc(n1)C
Complexity
200
Covalently-bondedUnitCount
1
HeavyAtomCount
15
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
UndefinedAtomStereocenterCount
1
Xlogp3
0.7
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CatalogNumber: AC80886
ChemicalName: [1-(6-Methylpyrazin-2-yl)piperid-3-yl]methanol
CasNumber: 937795-91-0
MolecularFormula: C11H17N3O
MolecularWeight: 207.2722
MdlNumber: MFCD09879916
Smiles: OCC1CCCN(C1)c1cncc(n1)C
Complexity: 200
Covalently-bondedUnitCount: 1
HeavyAtomCount: 15
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
UndefinedAtomStereocenterCount: 1
Xlogp3: 0.7
CatalogNumber:
AC80886
ChemicalName:
[1-(6-Methylpyrazin-2-yl)piperid-3-yl]methanol
CasNumber:
937795-91-0
MolecularFormula:
C11H17N3O
MolecularWeight:
207.2722
MdlNumber:
MFCD09879916
Smiles:
OCC1CCCN(C1)c1cncc(n1)C
Complexity:
200
Covalently-bondedUnitCount:
1
HeavyAtomCount:
15
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
UndefinedAtomStereocenterCount:
1
Xlogp3:
0.7
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Smiles: OC(=O)[C@H](c1ccc2c(c1)cccc2)N
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
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RotatableBondCount: __
UndefinedAtomStereocenterCount: __
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Smiles:
OC(=O)[C@H](c1ccc2c(c1)cccc2)N
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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UndefinedAtomStereocenterCount:
__
Xlogp3:
__
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Smiles: Nc1cc(ccc1Sc1ccccc1[N+](=O)[O-])S(=O)(=O)C
Complexity: __
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HeavyAtomCount: __
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MolecularWeight:
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Smiles:
Nc1cc(ccc1Sc1ccccc1[N+](=O)[O-])S(=O)(=O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OCC(COC(=O)c1ccc(cc1)O)O
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
UndefinedAtomStereocenterCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OCC(COC(=O)c1ccc(cc1)O)O
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
UndefinedAtomStereocenterCount:
__
Xlogp3:
__