In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 22 | No |
Popular Name: 3-[2-oxo-2-[4-(2-pyrrolidin-1-ylethyl)piperazin-1-yl]ethyl]thiazolidin-2-one 3-[2-oxo-2-[4-(2-pyrrolidin-1-yl…
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) | 0.27 | 5.45 | -48.29 | 1 | 6 | 1 | 48 | 327.474 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.27 | 3.01 | -16.07 | 0 | 6 | 0 | 47 | 326.466 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.