In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 8th, 2011 | 15 | Yes |
Popular Name: 1-(5-methylpyrazin-2-yl)-N-(thiadiazol-4-ylmethyl)methanamine 1-(5-methylpyrazin-2-yl)-N-(thia…
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) | 0.48 | 0.01 | -9.53 | 1 | 5 | 0 | 64 | 221.289 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.48 | 1.39 | -47.56 | 2 | 5 | 1 | 68 | 222.297 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.