Aglycone
AD40173
Formula: C13H21O3N2S
Smiles:
COc1ccc(CSCC([NH3+])C(=O)NCCO)cc1| HBA: | 5 | RingCount: | 1 |
| HBD: | 5 | FractionCSP3: | 0.46 |
| AlogP: | -0.35 | Num_rotatable_bonds: | 8 |
| MolWt: | 285.39 | Num_heavy_atoms: | 19 |
| TPSA: | 86.2 | NumAromaticRings: | 1 |