AI05016
100726-39-4 | 2-(2-(Pyridin-2-yl)-1h-benzo[d]imidazol-1-yl)acetic acid
Manufacturer: A2B Chem
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CatalogNumber
AI05016
ChemicalName
2-(2-(Pyridin-2-yl)-1h-benzo[d]imidazol-1-yl)acetic acid
CasNumber
100726-39-4
MolecularFormula
C14H11N3O2
MolecularWeight
253.25603999999998
MdlNumber
MFCD07186529
Smiles
OC(=O)Cn1c(nc2c1cccc2)c1ccccn1
Complexity
337
Covalently-bondedUnitCount
1
HeavyAtomCount
19
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
3
Xlogp3
1.8
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CatalogNumber: AI05016
ChemicalName: 2-(2-(Pyridin-2-yl)-1h-benzo[d]imidazol-1-yl)acetic acid
CasNumber: 100726-39-4
MolecularFormula: C14H11N3O2
MolecularWeight: 253.25603999999998
MdlNumber: MFCD07186529
Smiles: OC(=O)Cn1c(nc2c1cccc2)c1ccccn1
Complexity: 337
Covalently-bondedUnitCount: 1
HeavyAtomCount: 19
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 3
Xlogp3: 1.8
CatalogNumber:
AI05016
ChemicalName:
2-(2-(Pyridin-2-yl)-1h-benzo[d]imidazol-1-yl)acetic acid
CasNumber:
100726-39-4
MolecularFormula:
C14H11N3O2
MolecularWeight:
253.25603999999998
MdlNumber:
MFCD07186529
Smiles:
OC(=O)Cn1c(nc2c1cccc2)c1ccccn1
Complexity:
337
Covalently-bondedUnitCount:
1
HeavyAtomCount:
19
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
3
Xlogp3:
1.8
CatalogNumber: __
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Smiles: Nc1nnc(s1)SCc1cccc2c1cccc2
Complexity: __
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Smiles:
Nc1nnc(s1)SCc1cccc2c1cccc2
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Smiles: N#Cc1ccc(cc1Cl)n1cncc1
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Smiles:
N#Cc1ccc(cc1Cl)n1cncc1
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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Smiles: O=C1CCCCN1c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity: 414
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
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CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
O=C1CCCCN1c1ccc(cc1)B1OC(C(O1)(C)C)(C)C
Complexity:
414
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__