In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2011 | 24 | Yes |
Popular Name: 4-[2-(1H-indol-3-yl)ethyl]-N-(2-methoxyethyl)piperazine-1-carboxamide 4-[2-(1H-indol-3-yl)ethyl]-N-(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) | 2.38 | 4.63 | -11.65 | 2 | 6 | 0 | 61 | 330.432 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.38 | 6.84 | -49.3 | 3 | 6 | 1 | 62 | 331.44 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.