Aglycone
AD00316
Formula: C18H12N2S2
Smiles:
N#Cc1c2c(c(-c3cccs3)[nH]c1=S)CCc1ccccc1-2| HBA: | 2 | RingCount: | 4 |
| HBD: | 1 | FractionCSP3: | 0.11 |
| AlogP: | 5.11 | Num_rotatable_bonds: | 1 |
| MolWt: | 320.44 | Num_heavy_atoms: | 22 |
| TPSA: | 39.58 | NumAromaticRings: | 3 |
