In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 17th, 2010 | 14 | Yes |
Popular Name: N'-[(2-methylthiazol-4-yl)methyl]-N-propyl-ethane-1,2-diamine N'-[(2-methylthiazol-4-yl)methyl…
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) | 0.69 | 2.51 | -38.61 | 3 | 3 | 1 | 42 | 214.358 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.69 | 1.16 | -4.09 | 2 | 3 | 0 | 37 | 213.35 | 7 | ↓ |
Mid Mid (pH 6-8) | 0.69 | 3.86 | -115.19 | 4 | 3 | 2 | 46 | 215.366 | 7 | ↓ |