In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 19 | Yes |
Popular Name: (2R)-1-(5-chloro-2-thienyl)-2-(4-isopropylpiperazin-1-yl)propan-1-one (2R)-1-(5-chloro-2-thienyl)-2-(4…
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) | 3.09 | 7.36 | -33.6 | 1 | 3 | 1 | 25 | 301.863 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.09 | 4.94 | -4.6 | 0 | 3 | 0 | 24 | 300.855 | 4 | ↓ |