In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2009 | 18 | Yes |
Popular Name: 2-(methylamino)-1-[4-(thiophene-3-carbonyl)piperazin-1-yl]ethanone 2-(methylamino)-1-[4-(thiophene-…
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) | -0.51 | 3.69 | -53.3 | 2 | 5 | 1 | 57 | 268.362 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.51 | 2.25 | -14.97 | 1 | 5 | 0 | 53 | 267.354 | 3 | ↓ |