In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2004 | 28 | No |
Popular Name: 2-[2-[(Z)-(3-benzamido-4-keto-2-thioxo-thiazolidin-5-ylidene)methyl]phenoxy]acetate 2-[2-[(Z)-(3-benzamido-4-keto-2-…
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) | 1.94 | 9.19 | -59.1 | 1 | 7 | -1 | 100 | 413.456 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.01 | 8.55 | -114.6 | 0 | 7 | -2 | 107 | 412.448 | 6 | ↓ |