SMILES:
CC(=O)Nc1ccc2c(c1)CC1C2CCCN1C(=O)c1ccc2[nH]cnc2c1Molecular Processing
Molecular formula
C22H22N4O2
Molecular weight
374.44
Exact mass
374.1743
XLogP
3.47
TPSA
78.09
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
28
Rings
5
Aromatic rings
3
Saturated rings
1
Aliphatic rings
2
Stereo centers
2
Undefined stereo
2
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
107.34
Supplementary Information
詳細情報を取得中…
1 件の反応に参加→