In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2008 | 21 | Yes |
Popular Name: (2S)-1-(3,5-dimethylphenoxy)-3-(4-ethylpiperazin-1-yl)propan-2-ol (2S)-1-(3,5-dimethylphenoxy)-3-(…
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) | 2.47 | 5.34 | -35.75 | 2 | 4 | 1 | 37 | 293.431 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.47 | 3.04 | -5.64 | 1 | 4 | 0 | 36 | 292.423 | 6 | ↓ |