Glycoside
GD007244
Name:
NoneFormula:
C23H20O3N5ClSmiles:
Cc1nc2ccc(C3CC3)nc2n2c(-c3cc(OC4COCC4O)ccc3Cl)nnc12Aglycone:
Cc1nc2ccc(C3CC3)nc2n2c(-c3cc(O)ccc3Cl)nnc12Sugarmoiety:
OC1COCC1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 6 |
| HBD: | 1 | FractionCSP3: | 0.36 |
| AlogP: | 3.32 | Num_rotatable_bonds: | 4 |
| MolWt: | 437.89 | Num_heavy_atoms: | 31 |
| TPSA: | 94.66 | NumAromaticRings: | 4 |
Unique Aglycone
AD05911
Formula: C19H14ON5Cl
Smiles:
Cc1nc2ccc(C3CC3)nc2n2c(-c3cc(O)ccc3Cl)nnc12| HBA: | 6 | RingCount: | 5 |
| HBD: | 1 | FractionCSP3: | 0.22 |
| AlogP: | 3.88 | Num_rotatable_bonds: | 2 |
| MolWt: | 351.8 | Num_heavy_atoms: | 25 |
| TPSA: | 76.2 | NumAromaticRings: | 4 |
