In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2009 | 17 | Yes |
Popular Name: (1S)-1-[5-(2,5-dimethyl-3-furyl)-1H-imidazol-2-yl]-2-methyl-propan-1-amine (1S)-1-[5-(2,5-dimethyl-3-furyl)…
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) | -0.29 | 4.31 | -49.41 | 4 | 4 | 1 | 69 | 234.323 | 3 | ↓ |
Hi High (pH 8-9.5) | -0.29 | 4.39 | -7.92 | 3 | 4 | 0 | 68 | 233.315 | 3 | ↓ |
Lo Low (pH 4.5-6) | -0.29 | 4.8 | -115.73 | 5 | 4 | 2 | 71 | 235.331 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.