In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 13th, 2009 | 27 | Yes |
Popular Name: N-[2-(6-methoxy-1H-indol-3-yl)ethyl]-1-oxo-2H-isoquinoline-3-carboxamide N-[2-(6-methoxy-1H-indol-3-yl)et…
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) | 3.14 | 6.04 | -18.22 | 3 | 6 | 0 | 87 | 361.401 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.59 | 5.05 | -46.51 | 2 | 6 | -1 | 90 | 360.393 | 5 | ↓ |