In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 21 | No |
Popular Name: (5Z)-3-(2-aminoethyl)-5-(1-naphthylmethylene)thiazolidine-2,4-dione (5Z)-3-(2-aminoethyl)-5-(1-napht…
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) | 1.51 | 5.72 | -45.71 | 3 | 4 | 1 | 67 | 299.375 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.51 | 5.33 | -7.31 | 2 | 4 | 0 | 65 | 298.367 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.