In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 2nd, 2011 | 23 | No |
Popular Name: N-carbamoyl-3-[(2R)-2-(2,3-dihydro-1,4-benzodioxin-8-yl)pyrrolidin-1-yl]propanamide N-carbamoyl-3-[(2R)-2-(2,3-dihyd…
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) | 0.66 | 4.56 | -56.31 | 4 | 7 | 1 | 95 | 320.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.66 | 3.07 | -22.53 | 3 | 7 | 0 | 94 | 319.361 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.