In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 6th, 2008 | 20 | Yes |
Popular Name: N'-[(1S)-1-(1-adamantyl)ethyl]-N,N-diethyl-ethane-1,2-diamine N'-[(1S)-1-(1-adamantyl)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) | 4.15 | 8.04 | -40.15 | 2 | 2 | 1 | 20 | 279.492 | 7 | ↓ |
Hi High (pH 8-9.5) | 4.15 | 9.35 | -31.56 | 2 | 2 | 1 | 16 | 279.492 | 7 | ↓ |
Mid Mid (pH 6-8) | 4.15 | 10.36 | -120.3 | 3 | 2 | 2 | 21 | 280.5 | 7 | ↓ |