In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 15 | Yes |
Popular Name: N-[[(1R)-cyclohex-3-en-1-yl]methyl]-1-(4-methyl-1,2,4-triazol-3-yl)methanamine N-[[(1R)-cyclohex-3-en-1-yl]meth…
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) | 0.92 | 7.58 | -51.23 | 2 | 4 | 1 | 47 | 207.301 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.92 | 6.29 | -11.38 | 1 | 4 | 0 | 43 | 206.293 | 4 | ↓ |