Summary
Fragment ID 109519
Isomeric SMILES c1ccc(cc1)c1ccc(o1)c1ccccc1
InChI N/A
InChI key N/A
Terminal False
Shared True
Unfragmented False
Rule Of Three False
Standard Atoms True
Butyl Linker None
Molecular Properties
MW 220.27
Heavy Atoms 17
Carbons 16
Heteroatoms 1
Halides 0
Het/Carb Ratio 0.06
Formal Charge Count 0
Formal Charge Sum 0
Chiral Centers 0
Bonds 19
Rotable Bonds 2
Ring Systems 3
Aromatic Ring Systems 3
Lipinski Hydrogen Bond Donors 0
Lipinski Hydrogen Bond Acceptors 1
Topological PSA 13.14
XLogP 4.518
Fraction C sp3 0.0