| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| July 19th, 2011 | 16 | Yes |
Popular Name: (3S)-3-(dimethylaminomethyl)-4-(2-furylmethyl)-3H-1,2,4-triazol-5-one (3S)-3-(dimethylaminomethyl)-4-(…
| 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) | -0.14 | 2.53 | -10.26 | 1 | 6 | 0 | 67 | 222.248 | 4 | ↓ |
| Mid Mid (pH 6-8) | -0.14 | 5 | -49.02 | 2 | 6 | 1 | 68 | 223.256 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
