In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 21st, 2010 | 20 | Yes |
Popular Name: (1S)-1-(1-adamantyl)-2-(3,5-dimethyl-1,2,4-triazol-1-yl)ethanamine (1S)-1-(1-adamantyl)-2-(3,5-dime…
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) | 1.44 | 7.32 | -44.9 | 3 | 4 | 1 | 58 | 275.42 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.