In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 19 | Yes |
Popular Name: 3-[[ethyl(propyl)amino]methyl]benzothiophene-2-carboxylic 3-[[ethyl(propyl)amino]methyl]be…
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) | 3.70 | 10.18 | -40.85 | 1 | 3 | 0 | 45 | 277.389 | 6 | ↓ |
Hi High (pH 8-9.5) | 3.70 | 7.94 | -51.36 | 0 | 3 | -1 | 43 | 276.381 | 6 | ↓ |