In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 7th, 2008 | 25 | Yes |
Popular Name: (6aS)-3-(4-ethylpiperazine-1-carbonyl)-5,6a,7,8,9,10-hexahydropyrido[2,1-c]quinoxalin-6-one (6aS)-3-(4-ethylpiperazine-1-car…
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) | 1.14 | 6.02 | -48.97 | 2 | 6 | 1 | 57 | 343.451 | 2 | ↓ |
Mid Mid (pH 6-8) | 1.14 | 3.77 | -11.09 | 1 | 6 | 0 | 56 | 342.443 | 2 | ↓ |