In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 19th, 2008 | 15 | Yes |
Popular Name: N-[(2-methylthiazol-4-yl)methyl]-2-pyrrolidin-1-yl-ethanamine 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) | 0.81 | 4.03 | -35.68 | 2 | 3 | 1 | 29 | 226.369 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.81 | 1.51 | -5.7 | 1 | 3 | 0 | 28 | 225.361 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.81 | 2.91 | -38.77 | 2 | 3 | 1 | 33 | 226.369 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.81 | 5.45 | -112.68 | 3 | 3 | 2 | 34 | 227.377 | 5 | ↓ |