In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 25th, 2011 | 24 | Yes |
Popular Name: (2R)-1-[3-[(3,5-difluorobenzoyl)amino]propyl]-N,N-dimethyl-pyrrolidine-2-carboxamide (2R)-1-[3-[(3,5-difluorobenzoyl)…
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) | 0.99 | 6.67 | -48.13 | 2 | 5 | 1 | 54 | 340.394 | 6 | ↓ |
Hi High (pH 8-9.5) | 0.99 | 4.41 | -12.97 | 1 | 5 | 0 | 53 | 339.386 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.