In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2011 | 24 | Yes |
Popular Name: 7-[(1-benzylimidazol-2-yl)methyl]-2-methyl-6,8-dihydro-5H-pyrido[3,4-d]pyrimidine 7-[(1-benzylimidazol-2-yl)methyl…
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) | 1.32 | 8.73 | -36.36 | 1 | 5 | 1 | 48 | 320.42 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 8.16 | -12.86 | 0 | 5 | 0 | 47 | 319.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.32 | 10.4 | -51.4 | 1 | 5 | 1 | 48 | 320.42 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.