In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 18th, 2009 | 25 | Yes |
Popular Name: N-(6-piperazin-1-yl-3-pyridyl)adamantane-1-carboxamide N-(6-piperazin-1-yl-3-pyridyl)ad…
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) | 2.72 | 7.89 | -46.52 | 3 | 5 | 1 | 62 | 341.479 | 3 | ↓ |
Hi High (pH 8-9.5) | 2.72 | 6.59 | -8.84 | 2 | 5 | 0 | 57 | 340.471 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.72 | 8.21 | -101.32 | 4 | 5 | 2 | 63 | 342.487 | 3 | ↓ |