| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 19 | Yes |
Popular Name: (2S)-2-[2-cyanoethyl(isobutyl)amino]-N-[(1R)-1-methylbutyl]propanamide (2S)-2-[2-cyanoethyl(isobutyl)am…
| 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) | 2.13 | 8.07 | -45.19 | 2 | 4 | 1 | 57 | 268.425 | 9 | ↓ |
| Mid Mid (pH 6-8) | 2.13 | 5.75 | -9.77 | 1 | 4 | 0 | 56 | 267.417 | 9 | ↓ |
