AA65454
14714-22-8 | 6-Chloro-2-methylimidazo[1,2-b]pyridazine-3-carboxylic acid
Manufacturer: A2B Chem
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CatalogNumber
AA65454
ChemicalName
6-Chloro-2-methylimidazo[1,2-b]pyridazine-3-carboxylic acid
CasNumber
14714-22-8
MolecularFormula
C8H6ClN3O2
MolecularWeight
211.6051
MdlNumber
MFCD08704709
Smiles
Clc1ccc2n(n1)c(C(=O)O)c(n2)C
Complexity
251
Covalently-bondedUnitCount
1
HeavyAtomCount
14
HydrogenBondAcceptorCount
4
HydrogenBondDonorCount
1
RotatableBondCount
1
Xlogp3
1.5
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CatalogNumber: AA65454
ChemicalName: 6-Chloro-2-methylimidazo[1,2-b]pyridazine-3-carboxylic acid
CasNumber: 14714-22-8
MolecularFormula: C8H6ClN3O2
MolecularWeight: 211.6051
MdlNumber: MFCD08704709
Smiles: Clc1ccc2n(n1)c(C(=O)O)c(n2)C
Complexity: 251
Covalently-bondedUnitCount: 1
HeavyAtomCount: 14
HydrogenBondAcceptorCount: 4
HydrogenBondDonorCount: 1
RotatableBondCount: 1
Xlogp3: 1.5
CatalogNumber:
AA65454
ChemicalName:
6-Chloro-2-methylimidazo[1,2-b]pyridazine-3-carboxylic acid
CasNumber:
14714-22-8
MolecularFormula:
C8H6ClN3O2
MolecularWeight:
211.6051
MdlNumber:
MFCD08704709
Smiles:
Clc1ccc2n(n1)c(C(=O)O)c(n2)C
Complexity:
251
Covalently-bondedUnitCount:
1
HeavyAtomCount:
14
HydrogenBondAcceptorCount:
4
HydrogenBondDonorCount:
1
RotatableBondCount:
1
Xlogp3:
1.5
CatalogNumber: __
ChemicalName: __
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Smiles: CCOC(=O)c1c(C)nc2n1nc(Cl)cc2
Complexity: __
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HeavyAtomCount: __
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Smiles:
CCOC(=O)c1c(C)nc2n1nc(Cl)cc2
Complexity:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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Smiles: NCCCC[C@@H]1NC(=O)[C@H](NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@H](C(=O)N)[C@H](O)C)NC(=O)[C@@H](Cc1ccccc1)N)Cc1c[nH]c2c1cccc2
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
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Smiles:
NCCCC[C@@H]1NC(=O)[C@H](NC(=O)[C@H](Cc2ccc(cc2)O)NC(=O)[C@H](CSSC[C@H](NC1=O)C(=O)N[C@H](C(=O)N)[C@H](O)C)NC(=O)[C@@H](Cc1ccccc1)N)Cc1c[nH]c2c1cccc2
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
__
Xlogp3:
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Smiles: CCC=CCCCCCCC=O
Complexity: __
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HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
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ChemicalName:
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CasNumber:
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CCC=CCCCCCCC=O
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__