In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 7th, 2010 | 20 | Yes |
Popular Name: N-[[1-(1-piperidyl)cyclohexyl]methyl]-1-thiazol-4-yl-methanamine N-[[1-(1-piperidyl)cyclohexyl]me…
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) | 3.58 | 8.09 | -112.76 | 3 | 3 | 2 | 34 | 295.496 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.58 | 6.32 | -36.53 | 2 | 3 | 1 | 33 | 294.488 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.58 | 6.8 | -28.23 | 2 | 3 | 1 | 29 | 294.488 | 5 | ↓ |