CCCCCOC1=NC(=NC2=NC=C(N=C21)Cl)N
名称: 6-chloro-4-pentoxypteridin-2-amine
SMILES: CCCCCOC1=NC(=NC2=NC=C(N=C21)Cl)N

Molecular Processing

Molecular formula
C11H14ClN5O
Molecular weight
267.72
Exact mass
267.0887
XLogP
2.22
TPSA
86.81
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
18
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.455
Molar refractivity
69.57

Supplementary Information

InChIKey: KGXODUPLYYSISW-UHFFFAOYSA-N
同義語
SCHEMBL5515308KGXODUPLYYSISW-UHFFFAOYSA-N2-amino-6-chloro-4-n-pentyloxypteridine
出典を見る →
2 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→