In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2011 | 31 | No |
Popular Name: (6R)-6-benzyl-3-(4-isopropylphenyl)-6,7-dihydro-[1,2,4]triazino[2,3-c]quinazolin-2-one (6R)-6-benzyl-3-(4-isopropylphen…
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) | 6.14 | 13.06 | -24.79 | 2 | 5 | 1 | 65 | 409.513 | 4 | ↓ |
Hi High (pH 8-9.5) | 6.60 | 12.28 | -13.97 | 1 | 5 | 0 | 68 | 408.505 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.