In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 22 | Yes |
Popular Name: 2-amino-N-isobutyl-N-[(3,4,5-trimethoxyphenyl)methyl]acetamide 2-amino-N-isobutyl-N-[(3,4,5-tri…
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) | 0.62 | 4.41 | -53.16 | 3 | 6 | 1 | 76 | 311.402 | 8 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 4.04 | -13.2 | 2 | 6 | 0 | 74 | 310.394 | 8 | ↓ |