In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 19th, 2009 | 15 | Yes |
Popular Name: [4-[(4-methyl-1-piperidyl)methyl]thiazol-2-yl]methanamine [4-[(4-methyl-1-piperidyl)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) | 0.98 | 4.29 | -96.92 | 4 | 3 | 2 | 45 | 227.377 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 3.9 | -34.09 | 3 | 3 | 1 | 43 | 226.369 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.98 | 1.54 | -4.18 | 2 | 3 | 0 | 42 | 225.361 | 3 | ↓ |