AF30697
22368-21-4 | Eupatilin
Manufacturer: A2B Chem
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CatalogNumber
AF30697
ChemicalName
Eupatilin
CasNumber
22368-21-4
MolecularFormula
C18H16O7
MolecularWeight
344.3154
MdlNumber
MFCD13194819
Smiles
COc1cc(ccc1OC)c1cc(=O)c2c(o1)cc(c(c2O)OC)O
NscNumber
122413
Complexity
520
Covalently-bondedUnitCount
1
HeavyAtomCount
25
HydrogenBondAcceptorCount
7
HydrogenBondDonorCount
2
RotatableBondCount
4
Xlogp3
2.9
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CatalogNumber: AF30697
ChemicalName: Eupatilin
CasNumber: 22368-21-4
MolecularFormula: C18H16O7
MolecularWeight: 344.3154
MdlNumber: MFCD13194819
Smiles: COc1cc(ccc1OC)c1cc(=O)c2c(o1)cc(c(c2O)OC)O
NscNumber: 122413
Complexity: 520
Covalently-bondedUnitCount: 1
HeavyAtomCount: 25
HydrogenBondAcceptorCount: 7
HydrogenBondDonorCount: 2
RotatableBondCount: 4
Xlogp3: 2.9
CatalogNumber:
AF30697
ChemicalName:
Eupatilin
CasNumber:
22368-21-4
MolecularFormula:
C18H16O7
MolecularWeight:
344.3154
MdlNumber:
MFCD13194819
Smiles:
COc1cc(ccc1OC)c1cc(=O)c2c(o1)cc(c(c2O)OC)O
NscNumber:
122413
Complexity:
520
Covalently-bondedUnitCount:
1
HeavyAtomCount:
25
HydrogenBondAcceptorCount:
7
HydrogenBondDonorCount:
2
RotatableBondCount:
4
Xlogp3:
2.9
CatalogNumber: __
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Smiles: N#Cc1cccc(c1)[C@@H](O)C
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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Smiles:
N#Cc1cccc(c1)[C@@H](O)C
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Complexity:
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Covalently-bondedUnitCount:
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HeavyAtomCount:
__
HydrogenBondAcceptorCount:
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HydrogenBondDonorCount:
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RotatableBondCount:
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ChemicalName: __
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MolecularFormula: __
MolecularWeight: __
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Smiles: CCC(C1=CC=CC(=C1)C)O
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Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
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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(C1=CC=CC(=C1)C)O
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: __
NscNumber: __
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
RotatableBondCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
__
NscNumber:
__
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
RotatableBondCount:
__
Xlogp3:
__