In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 25 | Yes |
Popular Name: N'-(1-adamantyl)-N-(1-adamantylmethyl)ethane-1,2-diamine N'-(1-adamantyl)-N-(1-adamantylm…
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) | 5.39 | 11.41 | -136.72 | 4 | 2 | 2 | 33 | 344.587 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.39 | 10.19 | -42.85 | 3 | 2 | 1 | 29 | 343.579 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.39 | 10.22 | -38.15 | 3 | 2 | 1 | 29 | 343.579 | 6 | ↓ |