In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 25 | Yes |
Popular Name: 3-[[(3R)-3-(2-hydroxyethyl)-4-phenethyl-piperazin-1-yl]methyl]phenol 3-[[(3R)-3-(2-hydroxyethyl)-4-ph…
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) | 2.56 | 5.02 | -43.82 | 3 | 4 | 1 | 48 | 341.475 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 5.2 | -48.12 | 3 | 4 | 1 | 48 | 341.475 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 2.81 | -9.65 | 2 | 4 | 0 | 47 | 340.467 | 7 | ↓ |