In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 20 | Yes |
Popular Name: N-[(1R)-1-(5-ethyl-2-thienyl)ethyl]isoquinolin-5-amine N-[(1R)-1-(5-ethyl-2-thienyl)eth…
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) | 4.51 | 9.13 | -5.86 | 1 | 2 | 0 | 25 | 282.412 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.51 | 9.59 | -32.13 | 2 | 2 | 1 | 26 | 283.42 | 4 | ↓ |