CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)[C@H](C(=O)O)C(C)C
名称: Valsartan
SMILES: CCCCC(=O)N(Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1)[C@H](C(=O)O)C(C)C

Molecular Processing

Molecular formula
C24H29N5O3
Molecular weight
435.53
Exact mass
435.227
XLogP
4.16
TPSA
112.07
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
10
Heavy atoms
32
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
8
Covalent units
1
Fraction Csp3
0.375
Molar refractivity
121.39

Supplementary Information

詳細情報を取得中…

19 件の反応に参加→

拡張検索

部分構造検索→類似構造検索→