In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 15 | Yes |
Popular Name: (2R,3aR,7aR)-N-(2-hydroxyethyl)-2,3,3a,4,5,6,7,7a-octahydro-1H-indole-2-carboxamide (2R,3aR,7aR)-N-(2-hydroxyethyl)-…
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) | 1.36 | -0.05 | -37.33 | 4 | 4 | 1 | 66 | 213.301 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.36 | -1.2 | -9.99 | 3 | 4 | 0 | 61 | 212.293 | 3 | ↓ |