In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: 3-[(4-ethoxyphenyl)methylamino]-1-pyrrolidin-1-yl-propan-1-one 3-[(4-ethoxyphenyl)methylamino]-…
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) | 1.95 | 7.03 | -50.1 | 2 | 4 | 1 | 46 | 277.388 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.95 | 5.6 | -9.56 | 1 | 4 | 0 | 42 | 276.38 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.