In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2010 | 21 | Yes |
Popular Name: 1-[2-[(2S)-tetrahydrofuran-2-yl]ethylamino]isoquinoline-3-carboxylic 1-[2-[(2S)-tetrahydrofuran-2-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) | 2.34 | 7.85 | -35.42 | 2 | 5 | 0 | 76 | 286.331 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.34 | 7.53 | -64.9 | 1 | 5 | -1 | 74 | 285.323 | 5 | ↓ |