OCC1(CNc2cccc(Br)n2)CCOCC1
Name: (4-((6-bromopyridin-2-ylamino)methyl)tetrahydro-2H-pyran-4-yl)methanol
SMILES: OCC1(CNc2cccc(Br)n2)CCOCC1

Molecular Processing

Molecular formula
C12H17BrN2O2
Molecular weight
301.18
Exact mass
300.0473
XLogP
2.05
TPSA
54.38
H-bond donors
2
H-bond acceptors
4
Rotatable bonds
4
Heavy atoms
17
Rings
2
Aromatic rings
1
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.583
Molar refractivity
70

Supplementary Information

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