In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 14 | Yes |
Popular Name: (2R)-N-methyl-N-[[(3R)-3-piperidyl]methyl]pentan-2-amine (2R)-N-methyl-N-[[(3R)-3-piperid…
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) | 2.32 | 6.89 | -95.01 | 3 | 2 | 2 | 21 | 200.37 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 5.56 | -31.3 | 2 | 2 | 1 | 16 | 199.362 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 5.31 | -36.92 | 2 | 2 | 1 | 20 | 199.362 | 5 | ↓ |