Glycoside
GD127065
Name:
2-[5-({[(2,4-difluorophenyl)carbamoyl]amino}methyl)-3,4-dihydroxyoxolan-2-yl]-N-(propan-2-yl)acetamideFormula:
C17H23O5N3F2Smiles:
CC(C)N=C(O)CC1OC(CN=C(O)Nc2ccc(F)cc2F)C(O)C1OAglycone:
CC(O)=NC(C)C.CN=C(O)Nc1ccc(F)cc1FSugarmoiety:
OC1OC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 2 |
| HBD: | 5 | FractionCSP3: | 0.53 |
| AlogP: | 1.53 | Num_rotatable_bonds: | 6 |
| MolWt: | 387.38 | Num_heavy_atoms: | 27 |
| TPSA: | 126.9 | NumAromaticRings: | 1 |
Unique Aglycone
AD45654
Formula: C5H11ON
Smiles:
CC(O)=NC(C)C| HBA: | 2 | RingCount: | 0 |
| HBD: | 1 | FractionCSP3: | 0.8 |
| AlogP: | 1.37 | Num_rotatable_bonds: | 1 |
| MolWt: | 101.15 | Num_heavy_atoms: | 7 |
| TPSA: | 32.59 | NumAromaticRings: | 0 |
AD46245
Formula: C8H8ON2F2
Smiles:
CN=C(O)Nc1ccc(F)cc1F| HBA: | 3 | RingCount: | 1 |
| HBD: | 2 | FractionCSP3: | 0.12 |
| AlogP: | 1.92 | Num_rotatable_bonds: | 1 |
| MolWt: | 186.16 | Num_heavy_atoms: | 13 |
| TPSA: | 44.62 | NumAromaticRings: | 1 |
