In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | Yes |
Popular Name: 1-prop-2-ynyl-N-[4-(triazol-2-yl)phenyl]piperidin-4-amine 1-prop-2-ynyl-N-[4-(triazol-2-yl…
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) | 2.23 | 7.6 | -45.71 | 2 | 5 | 1 | 47 | 282.371 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.23 | 5.32 | -8.92 | 1 | 5 | 0 | 46 | 281.363 | 4 | ↓ |