In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 26th, 2009 | 21 | Yes |
Popular Name: 1-[(3S)-3-ethylmorpholin-4-yl]isoquinoline-3-carboxylic 1-[(3S)-3-ethylmorpholin-4-yl]is…
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) | 3.02 | 8.01 | -30.44 | 1 | 5 | 0 | 67 | 286.331 | 3 | ↓ |
Hi High (pH 8-9.5) | 3.02 | 7.62 | -59.25 | 0 | 5 | -1 | 65 | 285.323 | 3 | ↓ |