In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2010 | 14 | No |
Popular Name: 3-[[(1S,3S)-3-methylcyclohexyl]amino]-3-oxo-propanoic 3-[[(1S,3S)-3-methylcyclohexyl]a…
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) | 0.85 | 5.9 | -52.57 | 1 | 4 | -1 | 69 | 198.242 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.85 | 3.92 | -14.12 | 2 | 4 | 0 | 66 | 199.25 | 3 | ↓ |