| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2010 | 19 | Yes |
Popular Name: (2S)-2-(1-methylindolin-5-yl)-2-piperazin-1-yl-acetonitrile (2S)-2-(1-methylindolin-5-yl)-2-…
| 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) | 1.08 | 5.26 | -46.68 | 2 | 4 | 1 | 47 | 257.361 | 2 | ↓ |
| Hi High (pH 8-9.5) | 1.08 | 3.9 | -6.1 | 1 | 4 | 0 | 42 | 256.353 | 2 | ↓ |
