In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 17 | Yes |
Popular Name: (2-piperazin-1-yl-6,7-dihydro-5H-cyclopenta[b]pyridin-3-yl)methanamine (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) | 0.45 | 3.86 | -108.38 | 5 | 4 | 2 | 60 | 234.347 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.45 | 2.54 | -46.94 | 4 | 4 | 1 | 56 | 233.339 | 2 | ↓ |
Mid Mid (pH 6-8) | 0.45 | 4.29 | -188.28 | 6 | 4 | 3 | 62 | 235.355 | 2 | ↓ |