In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 25th, 2010 | 20 | No |
Popular Name: (3S)-3-[(4-isopropylthiazol-2-yl)amino]-1-[(1S)-1-methylpropyl]pyrrolidine-2,5-dione (3S)-3-[(4-isopropylthiazol-2-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) | 2.13 | 6.33 | -10.43 | 1 | 5 | 0 | 62 | 295.408 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.13 | 6.78 | -33.4 | 2 | 5 | 1 | 64 | 296.416 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.