In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 9th, 2009 | 20 | Yes |
Popular Name: N-[(S)-1-adamantyl-(1-methylpyrazol-4-yl)methyl]ethanamine N-[(S)-1-adamantyl-(1-methylpyra…
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) | 3.37 | 8.17 | -41.56 | 2 | 3 | 1 | 34 | 274.432 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.37 | 8.34 | -108.92 | 3 | 3 | 2 | 36 | 275.44 | 4 | ↓ |