In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 1st, 2009 | 13 | Yes |
Popular Name: N',N'-dimethyl-N-[(2-methylthiazol-5-yl)methyl]ethane-1,2-diamine N',N'-dimethyl-N-[(2-methylthiaz…
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) | 0.41 | 3.21 | -37.76 | 2 | 3 | 1 | 29 | 200.331 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.41 | 0.74 | -4.45 | 1 | 3 | 0 | 28 | 199.323 | 5 | ↓ |
Lo Low (pH 4.5-6) | 0.41 | 4.57 | -115.81 | 3 | 3 | 2 | 34 | 201.339 | 5 | ↓ |