| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 10th, 2011 | 18 | Yes |
Popular Name: (S)-(1-methylindolin-5-yl)-[(2S)-2-piperidyl]methanol (S)-(1-methylindolin-5-yl)-[(2S)…
| 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) | 1.88 | 5.4 | -36.52 | 3 | 3 | 1 | 40 | 247.362 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.88 | 4.1 | -3.69 | 2 | 3 | 0 | 35 | 246.354 | 2 | ↓ |
| Lo Low (pH 4.5-6) | 1.88 | 5.99 | -88.59 | 4 | 3 | 2 | 41 | 248.37 | 2 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
