Summary
Fragment ID 210078
Isomeric SMILES NC(c1ccc(cc1)c1ccc(o1)c1ccc(cc1)C(NC1C=CC=C1)N)NC1C=CC=C1
InChI N/A
InChI key N/A
Terminal False
Shared False
Unfragmented False
Rule Of Three False
Standard Atoms True
Butyl Linker None
Molecular Properties
MW 436.55
Heavy Atoms 33
Carbons 28
Heteroatoms 5
Halides 0
Het/Carb Ratio 0.18
Formal Charge Count 0
Formal Charge Sum 0
Chiral Centers 0
Bonds 37
Rotable Bonds 8
Ring Systems 5
Aromatic Ring Systems 3
Lipinski Hydrogen Bond Donors 4
Lipinski Hydrogen Bond Acceptors 5
Topological PSA 89.24
XLogP 5.326
Fraction C sp3 0.142857