Name: product
SMILES:
CCOC(=O)C(C(=O)OCC)c1ccc2c(Nc3cc(C)ccc3Sc3ccc(NC(C)=O)cc3)ccnc2n1Molecular Processing
Molecular formula
C30H30N4O5S
Molecular weight
558.66
Exact mass
558.1937
XLogP
6
TPSA
119.51
H-bond donors
2
H-bond acceptors
9
Rotatable bonds
10
Heavy atoms
40
Rings
4
Aromatic rings
4
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
10
Covalent units
1
Fraction Csp3
0.233
Molar refractivity
154.88
Supplementary Information
Details werden geladen…
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