In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
June 23rd, 2008 | 24 | No |
Popular Name: (5Z)-2-(3-pyridylamino)-5-(quinoxalin-5-ylmethylene)thiazol-4-one (5Z)-2-(3-pyridylamino)-5-(quino…
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) | 2.83 | 5.02 | -18.92 | 1 | 6 | 0 | 81 | 333.376 | 3 | ↓ |
Lo Low (pH 4.5-6) | 2.83 | 5.31 | -52.47 | 2 | 6 | 1 | 82 | 334.384 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.