| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 18th, 2011 | 18 | Yes |
Popular Name: (2S)-2-cyclopropyl-3-indolin-1-yl-2-(methylamino)propanenitrile (2S)-2-cyclopropyl-3-indolin-1-y…
| 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) | 2.53 | 6.43 | -10.06 | 1 | 3 | 0 | 39 | 241.338 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 2.53 | 7.49 | -47.43 | 2 | 3 | 1 | 44 | 242.346 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
