In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | Yes |
Popular Name: N-[4,5-dimethyl-3-(piperazine-1-carbonyl)-2-thienyl]pentanamide N-[4,5-dimethyl-3-(piperazine-1-…
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) | 1.63 | 5.9 | -58.79 | 3 | 5 | 1 | 66 | 324.47 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.63 | 4.53 | -11.86 | 2 | 5 | 0 | 61 | 323.462 | 5 | ↓ |