In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 27th, 2010 | 16 | No |
Popular Name: (2S)-2-amino-3-[(5-cyclopropyl-1,2,4-oxadiazol-3-yl)methylsulfanyl]propanoic (2S)-2-amino-3-[(5-cyclopropyl-1…
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) | -2.47 | 2.22 | -36.01 | 3 | 6 | 0 | 107 | 243.288 | 6 | ↓ |
Hi High (pH 8-9.5) | -2.47 | 1.88 | -44.56 | 2 | 6 | -1 | 105 | 242.28 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.