AI51608
518-82-1 | Emodin
Manufacturer: A2B Chem
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CatalogNumber
AI51608
ChemicalName
Emodin
CasNumber
518-82-1
MolecularFormula
C15H10O5
MolecularWeight
270.2369
MdlNumber
MFCD00001207
Smiles
Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O
Complexity
434
Covalently-bondedUnitCount
1
HeavyAtomCount
20
HydrogenBondAcceptorCount
5
HydrogenBondDonorCount
3
Xlogp3
2.7
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CatalogNumber: AI51608
ChemicalName: Emodin
CasNumber: 518-82-1
MolecularFormula: C15H10O5
MolecularWeight: 270.2369
MdlNumber: MFCD00001207
Smiles: Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O
Complexity: 434
Covalently-bondedUnitCount: 1
HeavyAtomCount: 20
HydrogenBondAcceptorCount: 5
HydrogenBondDonorCount: 3
Xlogp3: 2.7
CatalogNumber:
AI51608
ChemicalName:
Emodin
CasNumber:
518-82-1
MolecularFormula:
C15H10O5
MolecularWeight:
270.2369
MdlNumber:
MFCD00001207
Smiles:
Cc1cc(O)c2c(c1)C(=O)c1c(C2=O)c(O)cc(c1)O
Complexity:
434
Covalently-bondedUnitCount:
1
HeavyAtomCount:
20
HydrogenBondAcceptorCount:
5
HydrogenBondDonorCount:
3
Xlogp3:
2.7
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: FC(c1ccc(cc1)C(c1ccc2c(c1)OCO2)N1CCNCC1)(F)F
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
FC(c1ccc(cc1)C(c1ccc2c(c1)OCO2)N1CCNCC1)(F)F
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: [O-][N+](=O)c1ccc(c(c1)Oc1ccccc1)NS(=O)(=O)C
Complexity: 450
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: 2.6
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
[O-][N+](=O)c1ccc(c(c1)Oc1ccccc1)NS(=O)(=O)C
Complexity:
450
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
2.6
CatalogNumber: __
ChemicalName: __
CasNumber: __
MolecularFormula: __
MolecularWeight: __
MdlNumber: __
Smiles: OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)Oc1c[nH]c2c1c(Cl)c(cc2)Br
Complexity: __
Covalently-bondedUnitCount: __
HeavyAtomCount: __
HydrogenBondAcceptorCount: __
HydrogenBondDonorCount: __
Xlogp3: __
CatalogNumber:
__
ChemicalName:
__
CasNumber:
__
MolecularFormula:
__
MolecularWeight:
__
MdlNumber:
__
Smiles:
OC[C@H]1O[C@H]([C@@H]([C@@H]1O)O)Oc1c[nH]c2c1c(Cl)c(cc2)Br
Complexity:
__
Covalently-bondedUnitCount:
__
HeavyAtomCount:
__
HydrogenBondAcceptorCount:
__
HydrogenBondDonorCount:
__
Xlogp3:
__