| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 7th, 2010 | 18 | No |
Popular Name: [5-(3-aminoprop-1-ynyl)-3-pyridyl]-thiomorpholino-methanone [5-(3-aminoprop-1-ynyl)-3-pyridy…
| 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) | -0.96 | 3.88 | -57.14 | 3 | 4 | 1 | 61 | 262.358 | 1 | ↓ |
| Mid Mid (pH 6-8) | -0.96 | 3.47 | -8.03 | 2 | 4 | 0 | 59 | 261.35 | 1 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
