In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2008 | 16 | Yes |
Popular Name: (2S)-2-[[(1R,2R,3R)-2,3-dimethylcyclohexyl]amino]-N,N-dimethyl-propanamide (2S)-2-[[(1R,2R,3R)-2,3-dimethyl…
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) | 1.72 | 5.46 | -34.97 | 2 | 3 | 1 | 37 | 227.372 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.72 | 4.51 | -8.34 | 1 | 3 | 0 | 32 | 226.364 | 3 | ↓ |