AF30128
216955-75-8 | 6-(1H-Imidazol-1-yl)nicotinic acid
Manufacturer: A2B Chem
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CatalogNumber
AF30128
ChemicalName
6-(1H-Imidazol-1-yl)nicotinic acid
CasNumber
216955-75-8
MolecularFormula
C9H7N3O2
MolecularWeight
189.1708
MdlNumber
MFCD00140821
Smiles
OC(=O)c1ccc(nc1)n1cncc1
Complexity
222
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
2
Xlogp3
0.5
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CatalogNumber: AF30128
ChemicalName: 6-(1H-Imidazol-1-yl)nicotinic acid
CasNumber: 216955-75-8
MolecularFormula: C9H7N3O2
MolecularWeight: 189.1708
MdlNumber: MFCD00140821
Smiles: OC(=O)c1ccc(nc1)n1cncc1
Complexity: 222
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 2
Xlogp3: 0.5
CatalogNumber:
AF30128
ChemicalName:
6-(1H-Imidazol-1-yl)nicotinic acid
CasNumber:
216955-75-8
MolecularFormula:
C9H7N3O2
MolecularWeight:
189.1708
MdlNumber:
MFCD00140821
Smiles:
OC(=O)c1ccc(nc1)n1cncc1
Complexity:
222
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
2
Xlogp3:
0.5
CatalogNumber: AF30129
ChemicalName: 2-(4-(Trifluoromethyl)phenyl)propan-2-ol
CasNumber: 2252-62-2
MolecularFormula: C10H11F3O
MolecularWeight: 204.1889
MdlNumber: MFCD00096200
Smiles: CC(c1ccc(cc1)C(F)(F)F)(O)C
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
AF30129
ChemicalName:
2-(4-(Trifluoromethyl)phenyl)propan-2-ol
CasNumber:
2252-62-2
MolecularFormula:
C10H11F3O
MolecularWeight:
204.1889
MdlNumber:
MFCD00096200
Smiles:
CC(c1ccc(cc1)C(F)(F)F)(O)C
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: AF30130
ChemicalName: 6-Bromo-1h-imidazo[4,5-b]pyridine
CasNumber: 28279-49-4
MolecularFormula: C6H4BrN3
MolecularWeight: 198.0201
MdlNumber: MFCD00460092
Smiles: Brc1cc2nc[nH]c2nc1
Complexity: 130
Covalently-bondedUnitCount: 1
HeavyAtomCount: 10
HydrogenBondAcceptorCount: 2
HydrogenBondDonorCount: 1
RotatableBondCount: __
Xlogp3: 1.4
CatalogNumber:
AF30130
ChemicalName:
6-Bromo-1h-imidazo[4,5-b]pyridine
CasNumber:
28279-49-4
MolecularFormula:
C6H4BrN3
MolecularWeight:
198.0201
MdlNumber:
MFCD00460092
Smiles:
Brc1cc2nc[nH]c2nc1
Complexity:
130
Covalently-bondedUnitCount:
1
HeavyAtomCount:
10
HydrogenBondAcceptorCount:
2
HydrogenBondDonorCount:
1
RotatableBondCount:
__
Xlogp3:
1.4
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: Clc1nc(Cl)cc(c1)c1nnc(n1C)S
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
Clc1nc(Cl)cc(c1)c1nnc(n1C)S
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__