COC1CN(c2cc3c(ccn3C)nc2[C@H](C)N)C1
이름: (S)-1-(6-(3-Methoxyazetidin-1-yl)-1-methyl-1H-pyrrolo[3,2-b]pyridin-5-yl)ethanamine
SMILES: COC1CN(c2cc3c(ccn3C)nc2[C@H](C)N)C1

Molecular Processing

Molecular formula
C14H20N4O
Molecular weight
260.34
Exact mass
260.1637
XLogP
1.43
TPSA
56.31
H-bond donors
1
H-bond acceptors
4
Rotatable bonds
3
Heavy atoms
19
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
1
Undefined stereo
0
Formal charge
0
Heteroatoms
5
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
76.33

Supplementary Information

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