In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2011 | 26 | No |
Popular Name: 3-phenylspiro[7H-[1,2,4]triazino[2,3-c]quinazoline-6,1'-cyclohexane]-2-one 3-phenylspiro[7H-[1,2,4]triazino…
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) | 4.81 | 9.98 | -24.64 | 2 | 5 | 1 | 65 | 345.426 | 1 | ↓ |
Hi High (pH 8-9.5) | 5.27 | 9.15 | -17.54 | 1 | 5 | 0 | 68 | 344.418 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.