In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 9th, 2008 | 21 | Yes |
Popular Name: N'-benzyl-N-[(1R,3S)-1-ethyl-3-methyl-pentyl]-N'-methyl-propane-1,3-diamine N'-benzyl-N-[(1R,3S)-1-ethyl-3-m…
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) | 4.56 | 9.45 | -37.87 | 2 | 2 | 1 | 20 | 291.503 | 11 | ↓ |
Hi High (pH 8-9.5) | 4.56 | 10.91 | -36.56 | 2 | 2 | 1 | 16 | 291.503 | 11 | ↓ |