In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 12th, 2008 | 22 | Yes |
Popular Name: (1S)-1-(4-ethoxy-5-isopropyl-2-methyl-phenyl)-2-piperazin-1-yl-ethanol (1S)-1-(4-ethoxy-5-isopropyl-2-m…
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) | 2.23 | 4.12 | -42.29 | 3 | 4 | 1 | 49 | 307.458 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.23 | 2.77 | -5.13 | 2 | 4 | 0 | 45 | 306.45 | 6 | ↓ |