Common name
sanguinarine
Formula
C20H14NO4
CAS
5578-73-4
IUPAC name
13-methyl[1,3]benzodioxolo[5,6-c]-1,3-dioxolo[4,5-i]phenanthridinium
SMILES
C[n+]1cc2c(ccc3c2OCO3)c2ccc3cc4c(cc3c12)OCO4
INCHI
InChI=1S/C20H14NO4/c1-21-8-15-12(4-5-16-20(15)25-10-22-16)13-3-2-11-6-17-18(24-9-23-17)7-14(11)19(13)21/h2-8H,9-10H2,1H3/q+1
Physicochemical Properties
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Lipophilicity
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Water Solubility
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Geometric
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Electrostatic
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Flexibility
Num. Rot. bonds: 0
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AgroPAD
Photostability
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Topological
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Fungicide-likeness scores
The higher the score, the better the fungicide-likeness
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