In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 3rd, 2010 | 20 | No |
Popular Name: 2-sulfanyl-3-[(1R)-1-(2-thienyl)propyl]quinazolin-4-one 2-sulfanyl-3-[(1R)-1-(2-thienyl)…
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) | 3.40 | 9.73 | -10.59 | 1 | 3 | 0 | 38 | 302.424 | 3 | ↓ |
Mid Mid (pH 6-8) | 4.13 | 9.45 | -40.22 | 0 | 3 | -1 | 35 | 301.416 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.