In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 30th, 2008 | 27 | Yes |
Popular Name: 2-[[(3S)-4-[(2-ethoxyphenyl)methyl]-3-(2-hydroxyethyl)piperazin-1-yl]methyl]phenol 2-[[(3S)-4-[(2-ethoxyphenyl)meth…
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) | 2.98 | 4.81 | -37.77 | 3 | 5 | 1 | 57 | 371.501 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 4.67 | -31.84 | 3 | 5 | 1 | 57 | 371.501 | 8 | ↓ |
Mid Mid (pH 6-8) | 2.98 | 2.48 | -8.1 | 2 | 5 | 0 | 56 | 370.493 | 8 | ↓ |