In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: (2S,3S)-2-amino-N-hexyl-N-(2-hydroxyethyl)-3-methyl-pentanamide (2S,3S)-2-amino-N-hexyl-N-(2-hyd…
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) | 1.97 | 3.54 | -38.05 | 4 | 4 | 1 | 68 | 259.414 | 10 | ↓ |
Hi High (pH 8-9.5) | 1.97 | 3.23 | -9.17 | 3 | 4 | 0 | 67 | 258.406 | 10 | ↓ |