| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| October 20th, 2011 | 20 | Yes |
Popular Name: (2S)-2-amino-2-cyclopropyl-3-quinazolin-4-ylsulfanyl-propanoic (2S)-2-amino-2-cyclopropyl-3-qui…
| 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) | -0.14 | 6.98 | -39.27 | 3 | 5 | 0 | 94 | 289.36 | 5 | ↓ |
| Hi High (pH 8-9.5) | -0.14 | 6.79 | -50.36 | 2 | 5 | -1 | 92 | 288.352 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
