SMILES:
CCCOc1cc(F)cc(C[C@H](NC(C)=O)[C@H](O)[C@H]2CO[C@@H](OCC(C)(C)C)[C@H](C)N2C(=O)OC(C)(C)C)c1Molecular Processing
Molecular formula
C29H47FN2O7
Molecular weight
554.7
Exact mass
554.3367
XLogP
4.44
TPSA
106.56
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
10
Heavy atoms
39
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
5
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.724
Molar refractivity
145.97
Supplementary Information
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