In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 13th, 2010 | 17 | Yes |
Popular Name: 2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 2-piperazin-1-yl-6,7-dihydro-5H-…
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) | 1.02 | 6.21 | -40.21 | 2 | 4 | 1 | 57 | 229.307 | 1 | ↓ |
Hi High (pH 8-9.5) | 1.02 | 4.91 | -6.83 | 1 | 4 | 0 | 52 | 228.299 | 1 | ↓ |