In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 29th, 2008 | 29 | Yes |
Popular Name: N-[(5R,7S)-3-[4-[(2-methylthiazol-4-yl)methyl]piperazine-1-carbonyl]-1-adamantyl]acetamide N-[(5R,7S)-3-[4-[(2-methylthiazo…
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) | 1.43 | 5.55 | -14.33 | 1 | 6 | 0 | 66 | 416.591 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.43 | 7.56 | -57.75 | 2 | 6 | 1 | 67 | 417.599 | 4 | ↓ |