In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 24 | Yes |
Popular Name: 2-[3-[[benzyl(methyl)amino]methyl]phenyl]thiazole-4-carboxylic 2-[3-[[benzyl(methyl)amino]methy…
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) | 3.78 | 10.56 | -91.79 | 1 | 4 | 0 | 57 | 338.432 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.78 | 8.15 | -57.61 | 0 | 4 | -1 | 56 | 337.424 | 6 | ↓ |