| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| April 8th, 2011 | 21 | No |
Popular Name: 2-[(5-methylpyrazin-2-yl)methylamino]-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbothioamide 2-[(5-methylpyrazin-2-yl)methyla…
| 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) | 1.68 | 4.51 | -14.14 | 3 | 5 | 0 | 77 | 299.403 | 4 | ↓ |
| Mid Mid (pH 6-8) | 1.68 | 4.84 | -39.82 | 4 | 5 | 1 | 78 | 300.411 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
