In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2008 | 24 | Yes |
Popular Name: 1-adamantyl-[4-(2-thienylmethyl)piperazin-1-yl]methanone 1-adamantyl-[4-(2-thienylmethyl)…
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) | 3.79 | 8.33 | -7.34 | 0 | 3 | 0 | 24 | 344.524 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.79 | 10.66 | -46.79 | 1 | 3 | 1 | 25 | 345.532 | 3 | ↓ |