| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 19th, 2010 | 21 | Yes |
Popular Name: 1-piperazin-1-yl-3-quinazolin-4-ylsulfanyl-propan-1-one 1-piperazin-1-yl-3-quinazolin-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) | 1.18 | 6.56 | -56.61 | 2 | 5 | 1 | 63 | 303.411 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.18 | 5.27 | -14.03 | 1 | 5 | 0 | 58 | 302.403 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
