In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 27th, 2010 | 28 | Yes |
Popular Name: 2-[(2R)-1-[(4-ethoxyphenyl)methyl]-4-(1-propyl-4-piperidyl)piperazin-2-yl]ethanol 2-[(2R)-1-[(4-ethoxyphenyl)methy…
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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) | 2.99 | 5.77 | -38.34 | 2 | 5 | 1 | 40 | 390.592 | 9 | ↓ |
Mid Mid (pH 6-8) | 2.99 | 5.95 | -40.15 | 2 | 5 | 1 | 40 | 390.592 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.99 | 7.93 | -90.7 | 3 | 5 | 2 | 42 | 391.6 | 9 | ↓ |
Lo Low (pH 4.5-6) | 2.99 | 8.19 | -110.79 | 3 | 5 | 2 | 42 | 391.6 | 9 | ↓ |