In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 30 | Yes |
Popular Name: 2-[(2-keto-2-piperidino-ethyl)thio]-5-tetralin-6-yl-1H-thieno[2,3-d]pyrimidin-4-one 2-[(2-keto-2-piperidino-ethyl)th…
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 | 11.08 | -16.94 | 1 | 5 | 0 | 66 | 439.606 | 4 | ↓ |
Mid Mid (pH 6-8) | 5.84 | 9.84 | -48.69 | 0 | 5 | -1 | 69 | 438.598 | 4 | ↓ |