In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 13th, 2011 | 19 | Yes |
Popular Name: [6-[4-(2-dimethylaminoethyl)piperazin-1-yl]-3-pyridyl]methanol [6-[4-(2-dimethylaminoethyl)pipe…
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) | 0.40 | 3.52 | -77.07 | 3 | 5 | 2 | 45 | 266.389 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.40 | 0.72 | -7.02 | 1 | 5 | 0 | 43 | 264.373 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.40 | 3.2 | -40.64 | 2 | 5 | 1 | 44 | 265.381 | 5 | ↓ |