Summary
Fragment ID 37217
Isomeric SMILES Cc1ccc(cc1)c1ccco1
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 158.2
Heavy Atoms 12
Carbons 11
Heteroatoms 1
Halides 0
Het/Carb Ratio 0.09
Formal Charge Count 0
Formal Charge Sum 0
Chiral Centers 0
Bonds 13
Rotable Bonds 1
Ring Systems 2
Aromatic Ring Systems 2
Lipinski Hydrogen Bond Donors 0
Lipinski Hydrogen Bond Acceptors 1
Topological PSA 13.14
XLogP 3.014
Fraction C sp3 0.0909091