| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 18 | No |
Popular Name: N-[(3R)-1,1-dioxothian-3-yl]-3-methyl-5-nitro-imidazol-4-amine N-[(3R)-1,1-dioxothian-3-yl]-3-m…
| 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) | -0.15 | 4.69 | -67.59 | 2 | 8 | 1 | 114 | 275.31 | 3 | ↓ |
| Mid Mid (pH 6-8) | -0.15 | 4.38 | -25.21 | 1 | 8 | 0 | 110 | 274.302 | 3 | ↓ |
| Lo Low (pH 4.5-6) | -0.15 | 4.85 | -54.18 | 2 | 8 | 1 | 111 | 275.31 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
