CCn1c(C(=O)N(C2CC2)C2CC2)cc2c3c(ncn3C)c(Br)nc21
名称: 4-bromo-N,N-dicyclopropyl-6-ethyl-1-methyl-1,6-dihydroimidazo[4,5-d]pyrrolo[2,3-b]pyridine-7-carboxamide
SMILES: CCn1c(C(=O)N(C2CC2)C2CC2)cc2c3c(ncn3C)c(Br)nc21

Molecular Processing

Molecular formula
C18H20BrN5O
Molecular weight
402.3
Exact mass
401.0851
XLogP
3.47
TPSA
55.95
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
25
Rings
5
Aromatic rings
3
Saturated rings
2
Aliphatic rings
2
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
99.59

Supplementary Information

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