Summary
Fragment ID 170451
Isomeric SMILES NC(c1ccc(cc1)c1ccc(o1)c1ccccc1)N
InChI N/A
InChI key N/A
Terminal True
Shared True
Unfragmented False
Rule Of Three False
Standard Atoms True
Butyl Linker None
Molecular Properties
MW 264.32
Heavy Atoms 20
Carbons 17
Heteroatoms 3
Halides 0
Het/Carb Ratio 0.18
Formal Charge Count 0
Formal Charge Sum 0
Chiral Centers 0
Bonds 22
Rotable Bonds 3
Ring Systems 3
Aromatic Ring Systems 3
Lipinski Hydrogen Bond Donors 2
Lipinski Hydrogen Bond Acceptors 3
Topological PSA 65.18
XLogP 3.372
Fraction C sp3 0.0588235