Glycoside

GD009490
Name:
NoneFormula:
C23H24O5N2Smiles:
O=C(NCc1cc2ccccc2o1)[C@H](O)[C@H](O)C(=O)N1CCCC1c1ccccc1Aglycone:
NCc1cc2ccccc2o1.c1ccc(C2CCCN2)cc1Sugarmoiety:
O=C(O)C(O)C(O)C(=O)OOther Identifiers
Properties
HBA: | 7 | RingCount: | 4 |
HBD: | 3 | FractionCSP3: | 0.3 |
AlogP: | 2.13 | Num_rotatable_bonds: | 6 |
MolWt: | 408.45 | Num_heavy_atoms: | 30 |
TPSA: | 103.01 | NumAromaticRings: | 3 |
Unique Aglycone
AD01164
Formula: C10H13N
Smiles:
c1ccc(C2CCCN2)cc1HBA: | 1 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.4 |
AlogP: | 2.11 | Num_rotatable_bonds: | 1 |
MolWt: | 147.22 | Num_heavy_atoms: | 11 |
TPSA: | 12.03 | NumAromaticRings: | 1 |
AD07436
Formula: C9H9ON
Smiles:
NCc1cc2ccccc2o1HBA: | 2 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.11 |
AlogP: | 1.89 | Num_rotatable_bonds: | 1 |
MolWt: | 147.18 | Num_heavy_atoms: | 11 |
TPSA: | 39.16 | NumAromaticRings: | 2 |