In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 30th, 2011 | 22 | Yes |
Popular Name: N-[(5-ethyl-2-thienyl)methyl]-2-[4-(2-methoxyethyl)piperazin-1-yl]acetamide N-[(5-ethyl-2-thienyl)methyl]-2-…
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) | 1.92 | 5.12 | -34.65 | 2 | 5 | 1 | 46 | 326.486 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.92 | 2.76 | -8.21 | 1 | 5 | 0 | 45 | 325.478 | 8 | ↓ |
No pre-computed analogs available. Try a structural similarity search.