| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 19th, 2011 | 18 | No |
Popular Name: (3R)-3-(aminomethyl)-N-(2-furylmethyl)-N-methyl-1,1-dioxo-thian-3-amine (3R)-3-(aminomethyl)-N-(2-furylm…
| 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) | -0.34 | 1.25 | -44.75 | 3 | 5 | 1 | 78 | 273.378 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.34 | -0.27 | -54.05 | 3 | 5 | 1 | 78 | 273.378 | 4 | ↓ |
| Lo Low (pH 4.5-6) | -0.34 | 1.62 | -137.85 | 4 | 5 | 2 | 79 | 274.386 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
