| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 27th, 2011 | 24 | No |
Popular Name: (2S)-N-[(1R)-1-methylpropyl]-2-[4-(2-thiomorpholinoethyl)anilino]propanamide (2S)-N-[(1R)-1-methylpropyl]-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) | 3.70 | 9.47 | -44.91 | 3 | 4 | 1 | 46 | 350.552 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.70 | 7.37 | -8.62 | 2 | 4 | 0 | 44 | 349.544 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
