In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 5th, 2010 | 16 | Yes |
Popular Name: (2S)-2-amino-N-[[(1S,2S)-2-methylcyclohexyl]methyl]pentanamide (2S)-2-amino-N-[[(1S,2S)-2-methy…
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) | 2.25 | 4.06 | -42.51 | 4 | 3 | 1 | 57 | 227.372 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.25 | 3.72 | -6.37 | 3 | 3 | 0 | 55 | 226.364 | 5 | ↓ |