Aglycone

AD07481
Formula: C13H9N4SBr
Smiles:
N#CC1=C(N)NC(S)=C(C#N)C1c1ccc(Br)cc1HBA: | 4 | RingCount: | 2 |
HBD: | 3 | FractionCSP3: | 0.08 |
AlogP: | 2.49 | Num_rotatable_bonds: | 1 |
MolWt: | 333.21 | Num_heavy_atoms: | 19 |
TPSA: | 85.63 | NumAromaticRings: | 1 |