Common name
etaconazole
Formula
C14H15Cl2N3O2
CAS
60207-93-4
IUPAC name
1-[[2-(2,4-dichlorophenyl)-4-ethyl-1,3-dioxolan-2-yl]methyl]-1H-1,2,4-triazole
SMILES
CCC1COC(Cn2cncn2)(c2ccc(cc2Cl)Cl)O1
INCHI
InChI=1S/C14H15Cl2N3O2/c1-2-11-6-20-14(21-11,7-19-9-17-8-18-19)12-4-3-10(15)5-13(12)16/h3-5,8-9,11H,2,6-7H2,1H3
Physicochemical Properties
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Electrostatic
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Num. Rot. bonds: 4
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Fungicide-likeness scores
The higher the score, the better the fungicide-likeness
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