SMILES:
COc1cccc2c1OC1C3CCC4(CN(Cc5ccccc5)CCC214)C(CO)C3Molecular Processing
Molecular formula
C26H31NO3
Molecular weight
405.54
Exact mass
405.2304
XLogP
4.01
TPSA
41.93
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
30
Rings
7
Aromatic rings
2
Saturated rings
4
Aliphatic rings
5
Stereo centers
5
Undefined stereo
5
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.538
Molar refractivity
115.77
Supplementary Information
詳細情報を取得中…
2 件の反応に参加→