| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| December 30th, 2008 | 28 | Yes |
Popular Name: 2-[(2S)-4-(1H-indol-3-ylmethyl)-1-(1-isopropyl-4-piperidyl)piperazin-2-yl]ethanol 2-[(2S)-4-(1H-indol-3-ylmethyl)-…
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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) | 2.50 | 5.25 | -36.23 | 3 | 5 | 1 | 47 | 385.576 | 6 | ↓ |
| Hi High (pH 8-9.5) | 2.50 | 5.4 | -35.92 | 3 | 5 | 1 | 47 | 385.576 | 6 | ↓ |
| Mid Mid (pH 6-8) | 2.50 | 7.65 | -89.37 | 4 | 5 | 2 | 48 | 386.584 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 2.50 | 7.45 | -101.86 | 4 | 5 | 2 | 48 | 386.584 | 6 | ↓ |
