SMILES:
COc1cc(SC)ccc1C(=O)N1CCC2(CC1)Oc1ccccc1-c1c2cnn1CMolecular Processing
Molecular formula
C24H25N3O3S
Molecular weight
435.55
Exact mass
435.1617
XLogP
4.34
TPSA
56.59
H-bond donors
0
H-bond acceptors
5
Rotatable bonds
3
Heavy atoms
31
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.333
Molar refractivity
120.86
Supplementary Information
Récupération des détails…
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