In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 18 | Yes |
Popular Name: N-methyl-N-[(3-methyl-2-thienyl)methyl]-2-piperazin-1-yl-acetamide N-methyl-N-[(3-methyl-2-thienyl)…
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 | 3.93 | -41.92 | 2 | 4 | 1 | 40 | 268.406 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.66 | 2.57 | -9.9 | 1 | 4 | 0 | 36 | 267.398 | 4 | ↓ |