In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2009 | 25 | Yes |
Popular Name: 7-(4-ethylpiperazin-1-yl)-3-(4-methoxyphenyl)isothiazolo[4,5-d]pyrimidine 7-(4-ethylpiperazin-1-yl)-3-(4-m…
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) | 2.99 | 9.42 | -44.97 | 1 | 6 | 1 | 56 | 356.475 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.99 | 7.19 | -7.06 | 0 | 6 | 0 | 54 | 355.467 | 4 | ↓ |