이름: 3-amino-9-(2-hydroxy-4-methyl-pentyl)-2-pyridin-4-yl-6,7,8,9-tetrahydro-pyrimido[1,2-a]pyrimidin-4-one
SMILES:
CC(C)CC(O)CN1CCCn2c1nc(-c1ccncc1)c(N)c2=OMolecular Processing
Molecular formula
C18H25N5O2
Molecular weight
343.43
Exact mass
343.2008
XLogP
1.5
TPSA
97.27
H-bond donors
2
H-bond acceptors
6
Rotatable bonds
5
Heavy atoms
25
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
1
Undefined stereo
1
Formal charge
0
Heteroatoms
7
Covalent units
1
Fraction Csp3
0.5
Molar refractivity
98.43
Supplementary Information
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