In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 27 | Yes |
Popular Name: 2-ethoxy-6-[[(3S)-3-(2-hydroxyethyl)-4-(1-methyl-4-piperidyl)piperazin-1-yl]methyl]phenol 2-ethoxy-6-[[(3S)-3-(2-hydroxyet…
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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) | 1.60 | 2.1 | -41.54 | 3 | 6 | 1 | 61 | 378.537 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 2.36 | -41.56 | 3 | 6 | 1 | 61 | 378.537 | 7 | ↓ |
Lo Low (pH 4.5-6) | 1.60 | 4.51 | -106.57 | 4 | 6 | 2 | 62 | 379.545 | 7 | ↓ |