Glycoside
GD088619
Name:
NoneFormula:
C18H23O6N5SSmiles:
Cc1ccc(N2CCCc3sc(C(=O)N[C@H]4[C@@H](O)O[C@H](CO)[C@@H](O)[C@@H]4O)nc32)nn1Aglycone:
Cc1ccc(N2CCCc3sc(C(N)=O)nc32)nn1Sugarmoiety:
OCC1OC(O)C(O)C(O)C1OOther Identifiers
Properties
| HBA: | 11 | RingCount: | 4 |
| HBD: | 5 | FractionCSP3: | 0.56 |
| AlogP: | -1.14 | Num_rotatable_bonds: | 4 |
| MolWt: | 437.48 | Num_heavy_atoms: | 30 |
| TPSA: | 161.16 | NumAromaticRings: | 2 |
Unique Aglycone
AD38781
Formula: C12H13ON5S
Smiles:
Cc1ccc(N2CCCc3sc(C(N)=O)nc32)nn1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.33 |
| AlogP: | 1.42 | Num_rotatable_bonds: | 2 |
| MolWt: | 275.34 | Num_heavy_atoms: | 19 |
| TPSA: | 85.0 | NumAromaticRings: | 2 |
