Aglycone
AD40172
Formula: C13H22O2N3S
Smiles:
O=C(NCCO)C(c1ccsc1)N1CCC[NH2+]CC1| HBA: | 5 | RingCount: | 2 |
| HBD: | 4 | FractionCSP3: | 0.62 |
| AlogP: | -0.83 | Num_rotatable_bonds: | 5 |
| MolWt: | 284.41 | Num_heavy_atoms: | 19 |
| TPSA: | 69.18 | NumAromaticRings: | 1 |