In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 23 | Yes |
Popular Name: 6-ethyl-3-[(1R)-1-(piperazine-1-carbonyl)propyl]thieno[2,3-d]pyrimidin-4-one 6-ethyl-3-[(1R)-1-(piperazine-1-…
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) | 1.12 | 6.84 | -57.32 | 2 | 6 | 1 | 72 | 335.453 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.12 | 5.45 | -12.27 | 1 | 6 | 0 | 67 | 334.445 | 4 | ↓ |