In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 25 | Yes |
Popular Name: N-[2-[(9aS)-1,3,4,9a-tetrahydropyrido[3,4-b]indol-2-yl]ethyl]cycloheptanecarboxamide N-[2-[(9aS)-1,3,4,9a-tetrahydrop…
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) | 4.07 | 7.44 | -11.44 | 2 | 4 | 0 | 48 | 339.483 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.07 | 9.67 | -51.05 | 3 | 4 | 1 | 49 | 340.491 | 4 | ↓ |