In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 11th, 2009 | 17 | Yes |
Popular Name: 3-Amino-2-benzo[1,3]dioxol-5-yl-propionic acid ethyl ester 3-Amino-2-benzo[1,3]dioxol-5-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) | 0.67 | 3.58 | -54.65 | 3 | 5 | 1 | 72 | 238.263 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.67 | 3.21 | -7.45 | 2 | 5 | 0 | 71 | 237.255 | 5 | ↓ |