| In ZINC since | Heavy atoms | Benign functionality |
|---|---|---|
| September 14th, 2012 | 15 | Yes |
Popular Name: (S)-2-(Benzo[b]thiophen-3-ylamino)propanoic acid (S)-2-(Benzo[b]thiophen-3-ylamin…
Find On: PubMed — Wikipedia — Google
CAS Number: 72120-71-9
(S)-2-(Benzo[b]thiophen-3-ylamino)propanoicacid
| 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) | 1.48 | 6.29 | -43.95 | 1 | 3 | -1 | 52 | 220.273 | 3 | ↓ |
| Mid Mid (pH 6-8) | 1.48 | 6.58 | -29.6 | 2 | 3 | 0 | 57 | 221.281 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.