In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 22 | Yes |
Popular Name: N-(1,3-benzodioxol-5-ylmethyl)-1-(2-prop-2-ynoxyphenyl)methanamine N-(1,3-benzodioxol-5-ylmethyl)-1…
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) | 2.95 | 7.79 | -46.47 | 2 | 4 | 1 | 44 | 296.346 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.95 | 6.38 | -8.63 | 1 | 4 | 0 | 40 | 295.338 | 6 | ↓ |