In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 26th, 2008 | 25 | Yes |
Popular Name: N-[[1-(2-thienylmethyl)-4-piperidyl]methyl]-1,3-benzodioxole-5-carboxamide N-[[1-(2-thienylmethyl)-4-piperi…
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) | 3.12 | 8.32 | -53.34 | 2 | 5 | 1 | 52 | 359.471 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.12 | 6.03 | -14.85 | 1 | 5 | 0 | 51 | 358.463 | 5 | ↓ |