| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 27th, 2010 | 15 | Yes |
Popular Name: (2R,3aS,7aS)-N-(2-aminoethyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide (2R,3aS,7aS)-N-(2-aminoethyl)-2,…
| 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) | 0.80 | 0.51 | -96.65 | 6 | 4 | 2 | 73 | 213.325 | 3 | ↓ |
| Hi High (pH 8-9.5) | 0.80 | -1.04 | -9.44 | 4 | 4 | 0 | 67 | 211.309 | 3 | ↓ |
| Mid Mid (pH 6-8) | 0.80 | -0.66 | -50.84 | 5 | 4 | 1 | 69 | 212.317 | 3 | ↓ |
