In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 23 | No |
Popular Name: (2R)-5-amino-5-oxo-2-[(5Z)-4-oxo-5-(4-pyridylmethylene)-2-thioxo-thiazolidin-3-yl]pentanoic (2R)-5-amino-5-oxo-2-[(5Z)-4-oxo…
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) | -0.89 | 4.04 | -59.56 | 2 | 7 | -1 | 118 | 350.401 | 6 | ↓ |
Lo Low (pH 4.5-6) | -0.89 | 4.62 | -92.06 | 3 | 7 | 0 | 119 | 351.409 | 6 | ↓ |