In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 18 | Yes |
Popular Name: (1R,2S)-N2-ethyl-N1-methyl-N1-[(1R)-1-methylbutyl]cyclooctane-1,2-diamine (1R,2S)-N2-ethyl-N1-methyl-N1-[(…
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) | 4.67 | 8 | -30.48 | 2 | 2 | 1 | 16 | 255.47 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.67 | 6.7 | -32.01 | 2 | 2 | 1 | 20 | 255.47 | 6 | ↓ |