In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 19th, 2010 | 39 | No |
Popular Name: Aliskiren Aliskiren
Find On: PubMed — Wikipedia — Google
CAS Numbers: 173334-57-1 , 173399-03-6
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) | 4.27 | 4.71 | -68.54 | 7 | 9 | 1 | 148 | 552.777 | 19 | ↓ |
Hi High (pH 8-9.5) | 4.27 | 4.45 | -21.68 | 6 | 9 | 0 | 146 | 551.769 | 19 | ↓ |