Glycoside
Properties
HBA: | 18 | RingCount: | 3 |
HBD: | 9 | FractionCSP3: | 0.55 |
AlogP: | -2.22 | Num_rotatable_bonds: | 8 |
MolWt: | 521.21 | Num_heavy_atoms: | 32 |
TPSA: | 289.87 | NumAromaticRings: | 2 |
Unique Aglycone
AD00207
Formula: C5H4ON5
Smiles:
Nc1nc2c(c(=O)[nH]1)N=C[N]2HBA: | 6 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.0 |
AlogP: | -0.74 | Num_rotatable_bonds: | 0 |
MolWt: | 150.12 | Num_heavy_atoms: | 11 |
TPSA: | 98.23 | NumAromaticRings: | 1 |
AD06058
Formula: C2H9O9P3
Smiles:
COP(=O)(O)OP(=O)(O)CP(=O)(O)OHBA: | 9 | RingCount: | 0 |
HBD: | 4 | FractionCSP3: | 1.0 |
AlogP: | 0.07 | Num_rotatable_bonds: | 5 |
MolWt: | 270.01 | Num_heavy_atoms: | 14 |
TPSA: | 150.59 | NumAromaticRings: | 0 |