In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 17th, 2008 | 21 | Yes |
Popular Name: (1R)-N-methyl-N-(1-methyl-4-piperidyl)-1-(2,4,6-trimethylphenyl)ethane-1,2-diamine (1R)-N-methyl-N-(1-methyl-4-pipe…
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) | 1.08 | 6.7 | -38.42 | 3 | 3 | 1 | 34 | 290.475 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.08 | 7.71 | -35.59 | 3 | 3 | 1 | 34 | 290.475 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.08 | 9.08 | -100.9 | 4 | 3 | 2 | 35 | 291.483 | 4 | ↓ |