In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2004 | 33 | No |
Popular Name: 2-[[2-keto-2-(4-nitrophenyl)ethyl]thio]-5-tetralin-6-yl-thieno[2,3-d]pyrimidin-4-olate 2-[[2-keto-2-(4-nitrophenyl)ethy…
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) | 6.69 | 11.84 | -46.45 | 0 | 7 | -1 | 112 | 476.559 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.23 | 13.08 | -19.81 | 1 | 7 | 0 | 109 | 477.567 | 6 | ↓ |