In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 11th, 2010 | 15 | Yes |
Popular Name: N-[3-(3,5-dimethyl-1,2,4-triazol-1-yl)propyl]-2-methyl-propan-1-amine N-[3-(3,5-dimethyl-1,2,4-triazol…
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) | 0.46 | 6.55 | -48.25 | 2 | 4 | 1 | 47 | 211.333 | 6 | ↓ |
Lo Low (pH 4.5-6) | 0.46 | 6.98 | -92.31 | 3 | 4 | 2 | 49 | 212.341 | 6 | ↓ |