AD70132
1045792-66-2 | CAY10603
Manufacturer: A2B Chem
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CatalogNumber
AD70132
ChemicalName
CAY10603
CasNumber
1045792-66-2
MolecularFormula
C22H30N4O6
MolecularWeight
446.4968
MdlNumber
MFCD17010286
Smiles
ONC(=O)CCCCCCNC(=O)c1noc(c1)c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity
616
Covalently-bondedUnitCount
1
HeavyAtomCount
32
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
4
RotatableBondCount
12
Xlogp3
2.6
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CatalogNumber: AD70132
ChemicalName: CAY10603
CasNumber: 1045792-66-2
MolecularFormula: C22H30N4O6
MolecularWeight: 446.4968
MdlNumber: MFCD17010286
Smiles: ONC(=O)CCCCCCNC(=O)c1noc(c1)c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity: 616
Covalently-bondedUnitCount: 1
HeavyAtomCount: 32
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 4
RotatableBondCount: 12
Xlogp3: 2.6
CatalogNumber:
AD70132
ChemicalName:
CAY10603
CasNumber:
1045792-66-2
MolecularFormula:
C22H30N4O6
MolecularWeight:
446.4968
MdlNumber:
MFCD17010286
Smiles:
ONC(=O)CCCCCCNC(=O)c1noc(c1)c1ccc(cc1)NC(=O)OC(C)(C)C
Complexity:
616
Covalently-bondedUnitCount:
1
HeavyAtomCount:
32
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
4
RotatableBondCount:
12
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H]1O[C@H](C[C@@H]1O)Nc1ccccc1
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
OC[C@H]1O[C@H](C[C@@H]1O)Nc1ccccc1
Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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RotatableBondCount:
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Xlogp3:
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Smiles: CCCCCCCCCCCCN1CCOCC1
Complexity: __
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Smiles:
CCCCCCCCCCCCN1CCOCC1
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: Fc1cc(ccc1n1cncc1)[N+](=O)[O-]
Complexity: __
Covalently-bondedUnitCount: __
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:
Fc1cc(ccc1n1cncc1)[N+](=O)[O-]
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__