Aglycone

AD01555
Formula: C13H12O2N2S
Smiles:
CC(=O)C1=C(C)NC(S)=C(C#N)C1c1ccco1HBA: | 4 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.23 |
AlogP: | 2.49 | Num_rotatable_bonds: | 2 |
MolWt: | 260.32 | Num_heavy_atoms: | 18 |
TPSA: | 66.03 | NumAromaticRings: | 1 |
HBA: | 4 | RingCount: | 2 |
HBD: | 1 | FractionCSP3: | 0.23 |
AlogP: | 2.49 | Num_rotatable_bonds: | 2 |
MolWt: | 260.32 | Num_heavy_atoms: | 18 |
TPSA: | 66.03 | NumAromaticRings: | 1 |