| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 23rd, 2009 | 21 | Yes |
Popular Name: 4-[[(2S)-2-morpholino-2-(2-thienyl)ethyl]amino]-4-oxo-butanoic 4-[[(2S)-2-morpholino-2-(2-thien…
| 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) | 0.56 | 3.09 | -46.79 | 1 | 6 | -1 | 82 | 311.383 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.56 | 1.11 | -10.03 | 2 | 6 | 0 | 79 | 312.391 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.56 | 3.47 | -41.63 | 3 | 6 | 1 | 80 | 313.399 | 7 | ↓ |
| Lo Low (pH 4.5-6) | 0.56 | 5.45 | -64.73 | 2 | 6 | 0 | 83 | 312.391 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
