| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| May 13th, 2010 | 17 | Yes |
Popular Name: 2-(3-amino-1,2,4-triazol-1-yl)-6,7-dihydro-5H-cyclopenta[b]pyridine-3-carbonitrile 2-(3-amino-1,2,4-triazol-1-yl)-6…
| 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) | 0.64 | 8.2 | -12.02 | 2 | 6 | 0 | 93 | 226.243 | 1 | ↓ |
| Lo Low (pH 4.5-6) | 0.64 | 7.76 | -40.15 | 3 | 6 | 1 | 95 | 227.251 | 1 | ↓ |
| Lo Low (pH 4.5-6) | -2.90 | 8.69 | -34.07 | 3 | 6 | 1 | 95 | 227.251 | 1 | ↓ |
