In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 27 | Yes |
Popular Name: 5,6-dimethyl-3-(3-phenylpropyl)-2-(pyrrolidin-1-ylmethyl)thieno[2,3-d]pyrimidin-4-one 5,6-dimethyl-3-(3-phenylpropyl)-…
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) | 4.04 | 14.08 | -54.51 | 1 | 4 | 1 | 39 | 382.553 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.04 | 11.64 | -13.21 | 0 | 4 | 0 | 38 | 381.545 | 6 | ↓ |