In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 16 | Yes |
Popular Name: N1-methyl-N1-[(2-methylthiazol-4-yl)methyl]benzene-1,2-diamine N1-methyl-N1-[(2-methylthiazol-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) | 1.76 | 5.38 | -4.6 | 2 | 3 | 0 | 42 | 233.34 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.76 | 5.25 | -42.63 | 3 | 3 | 1 | 44 | 234.348 | 3 | ↓ |