In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 13th, 2010 | 26 | No |
Popular Name: (2E,5E)-2-[(2-chloro-3-pyridyl)imino]-3-cyclohexyl-5-(2-furylmethylene)thiazolidin-4-one (2E,5E)-2-[(2-chloro-3-pyridyl)i…
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) | 5.60 | 10.34 | -11.93 | 0 | 5 | 0 | 60 | 387.892 | 3 | ↓ |
Popular Name: 3-cyclopentyl-5-(2-furylmethylene)-2-(phenylimino)-1,3-thiazolidin-4-one 3-cyclopentyl-5-(2-furylmethylen…
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) | 5.37 | 9.76 | -8.66 | 0 | 4 | 0 | 48 | 338.432 | 3 | ↓ |
Ref Reference (pH 7) | 5.37 | 10.89 | -8.95 | 0 | 4 | 0 | 48 | 338.432 | 3 | ↓ |
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) | 8.38 | 16.82 | -10.14 | 0 | 4 | 0 | 48 | 463.002 | 4 | ↓ |
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) | 8.38 | 15.85 | -9.77 | 0 | 4 | 0 | 48 | 463.002 | 4 | ↓ |