Name: 1,6-dimethyl-8β-hydrazinomethyl-ergoline
SMILES:
CN1C[C@H](CNN)C[C@@H]2c3cccc4c3c(cn4C)C[C@H]21Molecular Processing
Molecular formula
C17H24N4
Molecular weight
284.41
Exact mass
284.2001
XLogP
1.6
TPSA
46.22
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
21
Rings
4
Aromatic rings
2
Saturated rings
1
Aliphatic rings
2
Stereo centers
3
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.529
Molar refractivity
86.08
Supplementary Information
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