In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 3rd, 2005 | 19 | Yes |
Popular Name: 2-benzo[1,3]dioxol-5-yl-N-(2-pyridylmethyl)ethanamine 2-benzo[1,3]dioxol-5-yl-N-(2-pyr…
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) | 2.02 | 5.88 | -47.81 | 2 | 4 | 1 | 48 | 257.313 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.02 | 4.52 | -8.42 | 1 | 4 | 0 | 43 | 256.305 | 5 | ↓ |