Glycoside
GD077671
Name:
NoneFormula:
C18H24O6N2SSmiles:
Cc1cc(C(=O)NCCO[C@@H]2O[C@@H](C)[C@@H](O)[C@@H](O)[C@@H]2O)c(-n2cccc2)s1Aglycone:
Cc1cc(C(=O)NCCO)c(-n2cccc2)s1Sugarmoiety:
CC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 4 | FractionCSP3: | 0.5 |
| AlogP: | 0.42 | Num_rotatable_bonds: | 6 |
| MolWt: | 396.47 | Num_heavy_atoms: | 27 |
| TPSA: | 113.18 | NumAromaticRings: | 2 |
Unique Aglycone
AD35552
Formula: C12H14O2N2S
Smiles:
Cc1cc(C(=O)NCCO)c(-n2cccc2)s1| HBA: | 4 | RingCount: | 2 |
| HBD: | 2 | FractionCSP3: | 0.25 |
| AlogP: | 1.57 | Num_rotatable_bonds: | 4 |
| MolWt: | 250.32 | Num_heavy_atoms: | 17 |
| TPSA: | 54.26 | NumAromaticRings: | 2 |
