In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 22nd, 2011 | 25 | Yes |
Popular Name: (4S)-4-(p-tolyl)-6-(3-pyridylmethyl)-1,3,4,7-tetrahydropyrrolo[3,4-d]pyrimidine-2,5-dione (4S)-4-(p-tolyl)-6-(3-pyridylmet…
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) | 1.58 | 6.15 | -18.8 | 2 | 6 | 0 | 74 | 334.379 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.58 | 6.62 | -45.11 | 3 | 6 | 1 | 76 | 335.387 | 3 | ↓ |