| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 21st, 2011 | 17 | No |
Popular Name: 4-[[cyclopropylmethyl(ethyl)amino]methyl]pyridine-2-carbothioamide 4-[[cyclopropylmethyl(ethyl)amin…
| 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) | 1.95 | 6.82 | -44.72 | 3 | 3 | 1 | 43 | 250.391 | 6 | ↓ |
| Hi High (pH 8-9.5) | 1.95 | 4.68 | -9.85 | 2 | 3 | 0 | 42 | 249.383 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
