In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 28th, 2004 | 27 | Yes |
Popular Name: 4-(3-acetylanilino)-6-methoxy-quinoline-3-carboxylic-acid-ethyl-ester 4-(3-acetylanilino)-6-methoxy-qu…
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) | 4.26 | 8.97 | -12.59 | 1 | 6 | 0 | 78 | 364.401 | 7 | ↓ |
Lo Low (pH 4.5-6) | 4.26 | 9.41 | -43.09 | 2 | 6 | 1 | 79 | 365.409 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.