In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 30th, 2009 | 23 | No |
Popular Name: (8-bromo-1,3,4,5-tetrahydropyrido[4,3-b]indol-2-yl)-(2-thioxo-1H-pyridin-3-yl)methanone (8-bromo-1,3,4,5-tetrahydropyrid…
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) | 2.96 | 7.73 | -59.95 | 1 | 4 | -1 | 49 | 387.282 | 1 | ↓ |
Mid Mid (pH 6-8) | 2.24 | 8.17 | -36.16 | 2 | 4 | 0 | 52 | 388.29 | 1 | ↓ |