AA13452
1140909-48-3 | Cabozantinib s-malate
Manufacturer: A2B Chem
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CatalogNumber
AA13452
ChemicalName
Cabozantinib s-malate
CasNumber
1140909-48-3
MolecularFormula
C32H30FN3O10
MolecularWeight
635.5931
MdlNumber
MFCD20923480
Smiles
OC(=O)C[C@@H](C(=O)O)O.COc1cc2c(ccnc2cc1OC)Oc1ccc(cc1)NC(=O)C1(CC1)C(=O)Nc1ccc(cc1)F
Complexity
924
Covalently-bondedUnitCount
2
DefinedAtomStereocenterCount
1
HeavyAtomCount
46
HydrogenBondAcceptorCount
12
HydrogenBondDonorCount
5
RotatableBondCount
11
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CatalogNumber: AA13452
ChemicalName: Cabozantinib s-malate
CasNumber: 1140909-48-3
MolecularFormula: C32H30FN3O10
MolecularWeight: 635.5931
MdlNumber: MFCD20923480
Smiles: OC(=O)C[C@@H](C(=O)O)O.COc1cc2c(ccnc2cc1OC)Oc1ccc(cc1)NC(=O)C1(CC1)C(=O)Nc1ccc(cc1)F
Complexity: 924
Covalently-bondedUnitCount: 2
DefinedAtomStereocenterCount: 1
HeavyAtomCount: 46
HydrogenBondAcceptorCount: 12
HydrogenBondDonorCount: 5
RotatableBondCount: 11
CatalogNumber:
AA13452
ChemicalName:
Cabozantinib s-malate
CasNumber:
1140909-48-3
MolecularFormula:
C32H30FN3O10
MolecularWeight:
635.5931
MdlNumber:
MFCD20923480
Smiles:
OC(=O)C[C@@H](C(=O)O)O.COc1cc2c(ccnc2cc1OC)Oc1ccc(cc1)NC(=O)C1(CC1)C(=O)Nc1ccc(cc1)F
Complexity:
924
Covalently-bondedUnitCount:
2
DefinedAtomStereocenterCount:
1
HeavyAtomCount:
46
HydrogenBondAcceptorCount:
12
HydrogenBondDonorCount:
5
RotatableBondCount:
11
CatalogNumber: __
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Smiles: O=Cc1cn2c(n1)sc1c2cccc1
Complexity: __
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DefinedAtomStereocenterCount: __
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Smiles:
O=Cc1cn2c(n1)sc1c2cccc1
Complexity:
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DefinedAtomStereocenterCount:
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HeavyAtomCount:
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HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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Smiles: OCc1cn2c(n1)sc1c2cccc1
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HeavyAtomCount: __
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Smiles:
OCc1cn2c(n1)sc1c2cccc1
Complexity:
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Covalently-bondedUnitCount:
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DefinedAtomStereocenterCount:
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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: CNCCCC(OCC)OCC
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MolecularFormula:
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MolecularWeight:
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MdlNumber:
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Smiles:
CNCCCC(OCC)OCC
Complexity:
__
Covalently-bondedUnitCount:
__
DefinedAtomStereocenterCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
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RotatableBondCount:
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