In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 21 | Yes |
Popular Name: 2-[(3R)-4-(2-ethoxyethyl)-3-ethyl-piperazin-1-yl]-1-pyrrolidin-1-yl-ethanone 2-[(3R)-4-(2-ethoxyethyl)-3-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) | 1.21 | 6.12 | -34.62 | 1 | 5 | 1 | 37 | 298.451 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.21 | 3.95 | -9.78 | 0 | 5 | 0 | 36 | 297.443 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.