Aglycone
AD00198
Formula: C22H18O4N2S
Smiles:
CCOC(=O)c1c(-c2ccccc2)[nH]c(=S)c(C#N)c1-c1ccc(OC)c(O)c1| HBA: | 6 | RingCount: | 3 |
| HBD: | 2 | FractionCSP3: | 0.14 |
| AlogP: | 4.84 | Num_rotatable_bonds: | 5 |
| MolWt: | 406.46 | Num_heavy_atoms: | 29 |
| TPSA: | 95.34 | NumAromaticRings: | 3 |