| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 25th, 2010 | 20 | No |
Popular Name: (2S)-1-imidazol-1-yl-N-[(2-methyl-3-nitro-phenyl)methyl]propan-2-amine (2S)-1-imidazol-1-yl-N-[(2-methy…
| 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) | 1.82 | 9.65 | -57.78 | 2 | 6 | 1 | 80 | 275.332 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.82 | 8.5 | -10.74 | 1 | 6 | 0 | 76 | 274.324 | 6 | ↓ |
| Lo Low (pH 4.5-6) | 1.82 | 10.16 | -121.11 | 3 | 6 | 2 | 82 | 276.34 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
