| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 27th, 2011 | 24 | Yes |
Popular Name: N-[2-[ethyl(isopropyl)amino]ethyl]-4-(3-pyridylmethyl)piperazine-1-carboxamide N-[2-[ethyl(isopropyl)amino]ethy…
| 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) | 1.68 | 5.65 | -41.99 | 2 | 6 | 1 | 53 | 334.488 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 1.68 | 7.88 | -97.84 | 3 | 6 | 2 | 54 | 335.496 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
