In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 29th, 2011 | 23 | Yes |
Popular Name: 4-[4-(2-thienylmethyl)piperazine-1-carbonyl]piperidine-1-carboxamide 4-[4-(2-thienylmethyl)piperazine…
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) | 0.93 | 3.36 | -15.51 | 2 | 6 | 0 | 70 | 336.461 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.93 | 5.56 | -55.13 | 3 | 6 | 1 | 71 | 337.469 | 3 | ↓ |