In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 24th, 2008 | 21 | Yes |
Popular Name: (1R)-1-(2-methoxy-5-methyl-phenyl)-N-methyl-N-(1-methyl-4-piperidyl)ethane-1,2-diamine (1R)-1-(2-methoxy-5-methyl-pheny…
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) | 0.31 | 4.99 | -30.77 | 3 | 4 | 1 | 43 | 292.447 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.31 | 5.72 | -35.49 | 3 | 4 | 1 | 43 | 292.447 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.31 | 7.47 | -99.45 | 4 | 4 | 2 | 44 | 293.455 | 5 | ↓ |