In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2010 | 23 | Yes |
Popular Name: 3,3-dimethyl-N-[2-[4-(thiophene-3-carbonyl)piperazin-1-yl]ethyl]butanamide 3,3-dimethyl-N-[2-[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) | 1.46 | 4.67 | -14.68 | 1 | 5 | 0 | 53 | 337.489 | 6 | ↓ |
Mid Mid (pH 6-8) | 1.46 | 6.92 | -51.52 | 2 | 5 | 1 | 54 | 338.497 | 6 | ↓ |