| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| February 4th, 2011 | 25 | No |
Popular Name: (2S)-N-(methylcarbamoyl)-2-[methyl-[3-(3-phenylisoxazol-5-yl)propyl]amino]propanamide (2S)-N-(methylcarbamoyl)-2-[meth…
| 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) | 1.90 | 7.71 | -61.28 | 3 | 7 | 1 | 89 | 345.423 | 7 | ↓ |
| Hi High (pH 8-9.5) | 1.90 | 5.44 | -26.74 | 2 | 7 | 0 | 87 | 344.415 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
