Glycoside

GD071424
Name:
NoneFormula:
C18H27O6N3Smiles:
O=C(NCC1CCN(Cc2ccncc2)CC1)C(=O)[C@H](O)[C@H](O)[C@H](O)COAglycone:
NCC1CCN(Cc2ccncc2)CC1Sugarmoiety:
O=C(O)C(=O)C(O)C(O)C(O)COOther Identifiers
Properties
HBA: | 9 | RingCount: | 2 |
HBD: | 5 | FractionCSP3: | 0.61 |
AlogP: | -1.95 | Num_rotatable_bonds: | 9 |
MolWt: | 381.43 | Num_heavy_atoms: | 27 |
TPSA: | 143.22 | NumAromaticRings: | 1 |
Unique Aglycone
AD33582
Formula: C12H19N3
Smiles:
NCC1CCN(Cc2ccncc2)CC1HBA: | 3 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.58 |
AlogP: | 1.25 | Num_rotatable_bonds: | 3 |
MolWt: | 205.31 | Num_heavy_atoms: | 15 |
TPSA: | 42.15 | NumAromaticRings: | 1 |