In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 6th, 2008 | 20 | Yes |
Popular Name: [4-(4-piperidylmethyl)piperazin-1-yl]-(2-thienyl)methanone [4-(4-piperidylmethyl)piperazin-…
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) | 1.37 | 4.9 | -47.34 | 2 | 4 | 1 | 40 | 294.444 | 3 | ↓ |
Mid Mid (pH 6-8) | 1.37 | 6.93 | -111.94 | 3 | 4 | 2 | 41 | 295.452 | 3 | ↓ |