이름: 6-amino-4-methyl-2,10-dihydro-9-oxa-1,2,4a-triaza-phenanthren-3-one
SMILES:
CC1C(=O)NN=C2COc3ccc(N)cc3N21Molecular Processing
Molecular formula
C11H12N4O2
Molecular weight
232.24
Exact mass
232.096
XLogP
0.3
TPSA
79.95
H-bond donors
2
H-bond acceptors
5
Rotatable bonds
0
Heavy atoms
17
Rings
3
Aromatic rings
1
Saturated rings
0
Aliphatic rings
2
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.273
Molar refractivity
63.87
Supplementary Information
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