| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| November 20th, 2009 | 16 | No |
Popular Name: (3S)-3-[[(3R)-tetrahydrothiophen-3-yl]amino]-3-(2-thienyl)propanoic (3S)-3-[[(3R)-tetrahydrothiophen…
| 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) | 1.74 | 6.81 | -30.39 | 2 | 3 | 0 | 57 | 257.38 | 5 | ↓ |
| Mid Mid (pH 6-8) | 1.74 | 5.91 | -43.89 | 1 | 3 | -1 | 52 | 256.372 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.
