In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 21 | Yes |
Popular Name: (1S)-1-(1-adamantyl)-N'-ethyl-N'-(2-methoxyethyl)-N-methyl-ethane-1,2-diamine (1S)-1-(1-adamantyl)-N'-ethyl-N'…
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) | 3.41 | 8.84 | -116.42 | 3 | 3 | 2 | 30 | 296.499 | 8 | ↓ |
Hi High (pH 8-9.5) | 3.41 | 7.76 | -34.05 | 2 | 3 | 1 | 26 | 295.491 | 8 | ↓ |