| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| January 28th, 2011 | 27 | No |
Popular Name: (2S)-N-(isobutylcarbamoyl)-2-[4-(2-thiomorpholinoethyl)anilino]propanamide (2S)-N-(isobutylcarbamoyl)-2-[4-…
| 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) | 3.27 | 9.43 | -54.79 | 4 | 6 | 1 | 75 | 393.577 | 8 | ↓ |
| Mid Mid (pH 6-8) | 3.27 | 7.33 | -17.91 | 3 | 6 | 0 | 73 | 392.569 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
