| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| August 2nd, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-N-[[(1S)-cyclohex-3-en-1-yl]methyl]butanediamide (2S)-2-amino-N-[[(1S)-cyclohex-3…
| 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) | 0.31 | -1.13 | -39.92 | 6 | 5 | 1 | 100 | 226.3 | 5 | ↓ |
| Hi High (pH 8-9.5) | 0.31 | -1.49 | -10.97 | 5 | 5 | 0 | 98 | 225.292 | 5 | ↓ |
