In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 15 | Yes |
Popular Name: (3R)-N-methyl-N-[(1R,2R)-2-methylcyclohexyl]piperidin-3-amine (3R)-N-methyl-N-[(1R,2R)-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) | 2.31 | 6.88 | -105.32 | 3 | 2 | 2 | 21 | 212.381 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.31 | 5.06 | -36.87 | 2 | 2 | 1 | 20 | 211.373 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.31 | 3.75 | -0.64 | 1 | 2 | 0 | 15 | 210.365 | 2 | ↓ |
Mid Mid (pH 6-8) | 2.31 | 5.54 | -29.45 | 2 | 2 | 1 | 16 | 211.373 | 2 | ↓ |