In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 23rd, 2010 | 24 | Yes |
Popular Name: N'-(2-adamantyl)-N-[(3S)-3,7-dimethyloctyl]ethane-1,2-diamine N'-(2-adamantyl)-N-[(3S)-3,7-dim…
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) | 5.75 | 12.18 | -127.8 | 4 | 2 | 2 | 33 | 336.608 | 11 | ↓ |
Hi High (pH 8-9.5) | 5.75 | 10.84 | -37.39 | 3 | 2 | 1 | 29 | 335.6 | 11 | ↓ |