In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 28th, 2010 | 32 | Yes |
Popular Name: 6-benzyl-3-(4-phenylpiperazine-1-carbonyl)-4H-isothiazolo[4,3-d]pyrimidine-5,7-dione 6-benzyl-3-(4-phenylpiperazine-1…
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) | 4.19 | 6.84 | -49.57 | 0 | 8 | -1 | 94 | 446.512 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.