이름: 3-[4-(2-hydroxyethyl)-1-piperazinyl]-5-methyl-6-phenyl-1,2,4-triazine
SMILES:
Cc1nc(N2CCN(CCO)CC2)nnc1-c1ccccc1Molecular Processing
Molecular formula
C16H21N5O
Molecular weight
299.38
Exact mass
299.1746
XLogP
0.96
TPSA
65.38
H-bond donors
1
H-bond acceptors
6
Rotatable bonds
4
Heavy atoms
22
Rings
3
Aromatic rings
2
Saturated rings
1
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
6
Covalent units
1
Fraction Csp3
0.438
Molar refractivity
85.74
Supplementary Information
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