SMILES:
COc1cccc(-c2nc(NC(=O)Nc3cccc(CN4CCCCC4)n3)cs2)c1Molecular Processing
Molecular formula
C22H25N5O2S
Molecular weight
423.54
Exact mass
423.1729
XLogP
4.84
TPSA
79.38
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
6
Heavy atoms
30
Rings
4
Aromatic rings
3
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.318
Molar refractivity
120.11
Supplementary Information
상세 정보 불러오는 중…
2개 반응에 참여→