SMILES:
C=CCC1C(C)C(=O)N1C(C(=O)OCc1ccccc1)=P(c1ccccc1)(c1ccccc1)c1ccccc1Molecular Processing
Molecular formula
C34H32NO3P
Molecular weight
533.61
Exact mass
533.212
XLogP
5.28
TPSA
46.61
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
9
Heavy atoms
39
Rings
5
Aromatic rings
4
Saturated rings
1
Aliphatic rings
1
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.147
Molar refractivity
161
Supplementary Information
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