In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2008 | 22 | Yes |
Popular Name: 2-[(2S)-4-[(2-ethoxyphenyl)methyl]-1-isopropyl-piperazin-2-yl]ethanol 2-[(2S)-4-[(2-ethoxyphenyl)methy…
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) | 2.32 | 4.95 | -33.06 | 2 | 4 | 1 | 37 | 307.458 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.32 | 2.77 | -6.12 | 1 | 4 | 0 | 36 | 306.45 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.32 | 5.15 | -33.72 | 2 | 4 | 1 | 37 | 307.458 | 7 | ↓ |