| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 28th, 2010 | 18 | Yes |
Popular Name: 5-[(3S)-3-propoxypiperidine-1-carbonyl]-1,2-dihydro-1,2,4-triazol-3-one 5-[(3S)-3-propoxypiperidine-1-ca…
| 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) | 0.29 | -0.12 | -44.08 | 1 | 7 | -1 | 94 | 253.282 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.29 | 0.1 | -20.92 | 2 | 7 | 0 | 95 | 254.29 | 4 | ↓ |
| Lo Low (pH 4.5-6) | 0.29 | -0.87 | -6.58 | 2 | 7 | 0 | 91 | 254.29 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
