Aglycone

AD12937
Formula: C15H15O2N3S
Smiles:
CCCSc1nc(-c2ccc(OC)cc2)c(C#N)c(=O)[nH]1HBA: | 5 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.27 |
AlogP: | 2.82 | Num_rotatable_bonds: | 5 |
MolWt: | 301.37 | Num_heavy_atoms: | 21 |
TPSA: | 78.77 | NumAromaticRings: | 2 |