In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2010 | 23 | No |
Popular Name: 3-(2-oxothiazolidin-3-yl)-N-[(2S)-2-pyrrolidin-1-yl-2-(2-thienyl)ethyl]propanamide 3-(2-oxothiazolidin-3-yl)-N-[(2S…
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) | 1.88 | 7.08 | -45.28 | 2 | 5 | 1 | 54 | 354.521 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.88 | 4.9 | -16.92 | 1 | 5 | 0 | 53 | 353.513 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.