In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 30th, 2008 | 23 | No |
Popular Name: (5Z)-2-(cyclohexylamino)-5-[(3-hydroxy-4-methoxy-phenyl)methylene]thiazol-4-one (5Z)-2-(cyclohexylamino)-5-[(3-h…
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) | 3.26 | 4.4 | -15.79 | 2 | 5 | 0 | 71 | 332.425 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.19 | 5.4 | -51.61 | 1 | 5 | -1 | 78 | 331.417 | 3 | ↓ |
Lo Low (pH 4.5-6) | 3.26 | 5.3 | -30.57 | 3 | 5 | 1 | 73 | 333.433 | 4 | ↓ |