In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 16 | No |
Popular Name: (3S)-3-[(2S,5S)-5-ethyl-2-methyl-morpholin-4-yl]pentanethioamide (3S)-3-[(2S,5S)-5-ethyl-2-methyl…
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) | 1.47 | 3.44 | -6.12 | 2 | 3 | 0 | 38 | 244.404 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.47 | 4.48 | -31.82 | 3 | 3 | 1 | 40 | 245.412 | 5 | ↓ |