이름: 2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]ethyl-trimethylazanium;chloride;hydrochloride
SMILES:
C[N+](C)(C)CCNC1=NN2C=CC=CC2=C1N.Cl.[Cl-]Molecular Processing
Molecular formula
C12H21Cl2N5
Molecular weight
306.24
Exact mass
305.1174
XLogP
-1.54
TPSA
55.35
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
19
Rings
2
Aromatic rings
2
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
7
Covalent units
3
Fraction Csp3
0.417
Molar refractivity
78.24
Supplementary Information
InChIKey: YMRAJEOVBAUWPM-UHFFFAOYSA-M
동의어
SCHEMBL1152333YMRAJEOVBAUWPM-UHFFFAOYSA-M2-[(3-aminopyrazolo[1,5-a]pyridin-2-yl)amino]-N,N,N-trimethylethanaminium chloride hydrochloride
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