In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 26 | Yes |
Popular Name: 2-[4-[2-(tert-butylamino)-2-oxo-ethyl]piperazin-1-yl]-N-ethyl-N-(2-thienylmethyl)acetamide 2-[4-[2-(tert-butylamino)-2-oxo-…
None
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) | 2.05 | 7.06 | -43.4 | 2 | 6 | 1 | 57 | 381.566 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 4.83 | -17.16 | 1 | 6 | 0 | 56 | 380.558 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.05 | 7.06 | -43.41 | 2 | 6 | 1 | 57 | 381.566 | 8 | ↓ |