In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 17th, 2010 | 15 | Yes |
Popular Name: 2-[(2R)-4-(2,2-dimethylpropyl)-1-methyl-piperazin-2-yl]ethanol 2-[(2R)-4-(2,2-dimethylpropyl)-1…
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) | 1.56 | 2.41 | -33.62 | 2 | 3 | 1 | 28 | 215.361 | 4 | ↓ |
Hi High (pH 8-9.5) | 1.56 | 0.82 | -2.94 | 1 | 3 | 0 | 27 | 214.353 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.56 | 3.14 | -33.18 | 2 | 3 | 1 | 28 | 215.361 | 4 | ↓ |