| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 2nd, 2011 | 19 | Yes |
Popular Name: (2S)-2-(cyclopropylamino)-4-[(2R,5S)-5-ethyl-2-methyl-morpholin-4-yl]butanamide (2S)-2-(cyclopropylamino)-4-[(2R…
| 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) | 1.12 | 0.02 | -7.22 | 3 | 5 | 0 | 68 | 269.389 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 0.93 | -40.44 | 4 | 5 | 1 | 72 | 270.397 | 7 | ↓ |
| Mid Mid (pH 6-8) | 1.12 | 2.18 | -42.06 | 4 | 5 | 1 | 69 | 270.397 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.12 | 3.09 | -116.07 | 5 | 5 | 2 | 73 | 271.405 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
