In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 28th, 2011 | 19 | Yes |
Popular Name: N,N-dimethyl-1-[(2R)-4-thieno[3,2-d]pyrimidin-4-ylmorpholin-2-yl]methanamine N,N-dimethyl-1-[(2R)-4-thieno[3,…
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) | 1.39 | 6.8 | -40.2 | 1 | 5 | 1 | 43 | 279.389 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 4.27 | -8.36 | 0 | 5 | 0 | 41 | 278.381 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.39 | 7.25 | -77.06 | 2 | 5 | 2 | 44 | 280.397 | 3 | ↓ |