In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2008 | 27 | Yes |
Popular Name: (1-Ethyl-pyrrolidin-2-ylmethyl)-[2-(2-fluoro-benzyloxy)-3-methoxy-benzyl]-amine (1-Ethyl-pyrrolidin-2-ylmethyl)-…
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) | 3.82 | 10.16 | -37.52 | 2 | 4 | 1 | 38 | 373.492 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.82 | 10.58 | -34.39 | 2 | 4 | 1 | 35 | 373.492 | 9 | ↓ |
Lo Low (pH 4.5-6) | 3.82 | 11.97 | -116.8 | 3 | 4 | 2 | 40 | 374.5 | 9 | ↓ |
No pre-computed analogs available. Try a structural similarity search.