Glycoside
GD040534
Name:
n-{2-chloro-5-[({2-[3-(prop-1-en-2-yl)phenyl]propan-2-yl}carbamoyl)amino]phenyl}-beta-d-ribopyranosylamineFormula:
C25H30O5N3ClSmiles:
C=C(C)c1cccc(C(C)(C)NC(=O)Nc2ccc(Cl)c(N[C@H]3OC[C@H](O)[C@H](O)[C@@H]3O)c2)c1Aglycone:
C=C(C)c1cccc(C(C)(C)NC(=O)Nc2ccc(Cl)c(N)c2)c1Sugarmoiety:
OC1COC(O)C(O)C1OOther Identifiers
Properties
| HBA: | 8 | RingCount: | 3 |
| HBD: | 6 | FractionCSP3: | 0.38 |
| AlogP: | 3.28 | Num_rotatable_bonds: | 6 |
| MolWt: | 475.97 | Num_heavy_atoms: | 33 |
| TPSA: | 123.08 | NumAromaticRings: | 2 |
Unique Aglycone
AD23958
Formula: C20H22ON3Cl
Smiles:
C=C(C)c1cccc(C(C)(C)NC(=O)Nc2ccc(Cl)c(N)c2)c1| HBA: | 4 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.21 |
| AlogP: | 5.01 | Num_rotatable_bonds: | 4 |
| MolWt: | 343.86 | Num_heavy_atoms: | 24 |
| TPSA: | 67.15 | NumAromaticRings: | 2 |
