Glycoside
GD078331
Name:
NoneFormula:
C16H18O4N6SSmiles:
CSC[C@H]1O[C@@H](n2cnc3c(Nc4ccc(=O)[nH]c4)ncnc32)[C@H](O)[C@@H]1OAglycone:
O=c1ccc(Nc2ncnc3c2N=C[N]3)c[nH]1Sugarmoiety:
CSCC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 10 | RingCount: | 4 |
| HBD: | 4 | FractionCSP3: | 0.38 |
| AlogP: | 0.24 | Num_rotatable_bonds: | 5 |
| MolWt: | 390.43 | Num_heavy_atoms: | 27 |
| TPSA: | 138.18 | NumAromaticRings: | 3 |
Unique Aglycone
AD35952
Formula: C10H7ON6
Smiles:
O=c1ccc(Nc2ncnc3c2N=C[N]3)c[nH]1| HBA: | 7 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.0 |
| AlogP: | 0.82 | Num_rotatable_bonds: | 2 |
| MolWt: | 227.21 | Num_heavy_atoms: | 17 |
| TPSA: | 97.13 | NumAromaticRings: | 2 |
