이름: (S)-4-(5-(1-aminoethyl)-1-methyl-1H-pyrrolo[3,2-b]pyridin-6-yl)pyridin-2-ol hydrochloride
SMILES:
C[C@H](N)c1nc2ccn(C)c2cc1-c1ccnc(O)c1.ClMolecular Processing
Molecular formula
C15H17ClN4O
Molecular weight
304.78
Exact mass
304.1091
XLogP
2.78
TPSA
76.96
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
2
Heavy atoms
21
Rings
3
Aromatic rings
3
Saturated rings
0
Aliphatic rings
0
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
2
Fraction Csp3
0.2
Molar refractivity
85.46
Supplementary Information
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