Aglycone

AD43922
Formula: C16H17O2N3S
Smiles:
Cc1nc(-c2ccc(OCC(C)C)c(C#N)c2)sc1C(N)=OHBA: | 5 | RingCount: | 2 |
HBD: | 2 | FractionCSP3: | 0.31 |
AlogP: | 3.12 | Num_rotatable_bonds: | 5 |
MolWt: | 315.4 | Num_heavy_atoms: | 22 |
TPSA: | 89.0 | NumAromaticRings: | 2 |