In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 17 | Yes |
Popular Name: (2S,3aS,7aS)-2-[[(2S)-2-methylmorpholin-4-yl]methyl]-2,3,3a,4,5,6,7,7a-octahydro-1H-indole (2S,3aS,7aS)-2-[[(2S)-2-methylmo…
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) | 3.12 | 4.15 | -36.51 | 2 | 3 | 1 | 29 | 239.383 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.12 | 6.71 | -123.67 | 3 | 3 | 2 | 30 | 240.391 | 2 | ↓ |