In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | Yes |
Popular Name: (2S)-2-(4,5-dimethyl-1H-imidazol-2-yl)-3,4-dihydro-2H-1,4-benzoxazine (2S)-2-(4,5-dimethyl-1H-imidazol…
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) | 1.78 | 4.5 | -28.22 | 3 | 4 | 1 | 51 | 230.291 | 1 | ↓ |
Mid Mid (pH 6-8) | 1.78 | 4.13 | -6.61 | 2 | 4 | 0 | 50 | 229.283 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.