In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 29th, 2010 | 22 | Yes |
Popular Name: (11bR)-2-butyl-9,10-dimethoxy-1,3,4,6,7,11b-hexahydropyrazino[2,1-a]isoquinoline (11bR)-2-butyl-9,10-dimethoxy-1,…
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) | 2.87 | 7.45 | -42.11 | 1 | 4 | 1 | 26 | 305.442 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.87 | 5.2 | -6.4 | 0 | 4 | 0 | 25 | 304.434 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.87 | 9.61 | -124.37 | 2 | 4 | 2 | 27 | 306.45 | 5 | ↓ |