In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 14th, 2005 | 21 | No |
Popular Name: 2-(2-chlorophenyl)imino-5-(3-pyridylmethylene)thiazolidin-4-one 2-(2-chlorophenyl)imino-5-(3-pyr…
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) | 3.54 | 6.52 | -40.14 | 0 | 4 | -1 | 57 | 314.777 | 3 | ↓ |
Ref Reference (pH 7) | 4.04 | 6.9 | -9.65 | 1 | 4 | 0 | 58 | 315.785 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.49 | 4.6 | -47.41 | 0 | 4 | -1 | 61 | 314.777 | 2 | ↓ |
Hi High (pH 8-9.5) | 4.49 | 5 | -44.24 | 0 | 4 | -1 | 61 | 314.777 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.04 | 7.18 | -48.22 | 2 | 4 | 1 | 59 | 316.793 | 2 | ↓ |