In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 19th, 2010 | 17 | Yes |
Popular Name: 2-Amino-3-(1,2-dihydro-2-oxoquinoline-4-yl)propanoic acid 2-Amino-3-(1,2-dihydro-2-oxoquin…
Find On: PubMed — Wikipedia — Google
CAS Number: 5162-90-3
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) | -1.63 | 3.3 | -74.22 | 4 | 5 | 1 | 99 | 233.247 | 3 | ↓ |
Hi High (pH 8-9.5) | -1.63 | 2.97 | -48.32 | 3 | 5 | 0 | 97 | 232.239 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.