In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 21 | No |
Popular Name: (E)-3-[4-[[methyl-[(2-methylthiazol-4-yl)methyl]amino]methyl]phenyl]prop-2-enoic (E)-3-[4-[[methyl-[(2-methylthia…
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) | 2.00 | 9.94 | -77.72 | 1 | 4 | 0 | 57 | 302.399 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.00 | 7.56 | -52.22 | 0 | 4 | -1 | 56 | 301.391 | 6 | ↓ |