| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 2nd, 2009 | 21 | Yes |
Popular Name: (2S,3aS,7aS)-N-ethyl-N-(4-pyridylmethyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide (2S,3aS,7aS)-N-ethyl-N-(4-pyridy…
| Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
|---|---|---|---|---|---|---|---|---|---|---|
| Ref Reference (pH 7) | 2.72 | 7.37 | -39.96 | 2 | 4 | 1 | 50 | 288.415 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.72 | 7.82 | -83.15 | 3 | 4 | 2 | 51 | 289.423 | 4 | ↓ |
