In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 9th, 2010 | 28 | Yes |
Popular Name: (1S,9aS)-2-benzyl-1-(3-methoxyphenyl)-1,3,4,9a-tetrahydropyrido[3,4-b]indole (1S,9aS)-2-benzyl-1-(3-methoxyph…
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) | 5.38 | 12.49 | -39.3 | 2 | 3 | 1 | 29 | 369.488 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.38 | 10.4 | -8.01 | 1 | 3 | 0 | 28 | 368.48 | 4 | ↓ |