이름: (S)-1-(1-methyl-6-(pyridin-2-yl)-1H-pyrrolo[3,2-b]pyridin-5-yl)ethanamine hydrochloride
SMILES:
C[C@H](N)c1nc2ccn(C)c2cc1-c1ccccn1.ClMolecular Processing
Molecular formula
C15H17ClN4
Molecular weight
288.78
Exact mass
288.1142
XLogP
3.08
TPSA
56.73
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
20
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
2
Fraction Csp3
0.2
Molar refractivity
83.8
Supplementary Information
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