이름: 6-(4-Bromo-2-methyl-phenylamino)-7-fluoro-3-pent-4-enyl-3H-benzoimidazole-5-carboxylic acid cyclopropylmethoxy-amide
SMILES:
C=CCCCn1cnc2c(F)c(Nc3ccc(Br)cc3C)c(C(=O)NOCC3CC3)cc21Molecular Processing
Molecular formula
C24H26BrFN4O2
Molecular weight
501.4
Exact mass
500.1223
XLogP
6.03
TPSA
68.18
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
10
Heavy atoms
32
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
0.333
Molar refractivity
127.43
Supplementary Information
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