In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2009 | 20 | Yes |
Popular Name: (3aS)-4-[2-(dimethylamino)acetyl]-2,3,3a,9-tetrahydropyrrolo[2,1-b]quinazolin-1-one (3aS)-4-[2-(dimethylamino)acetyl…
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) | 0.71 | 6.52 | -56.58 | 1 | 5 | 1 | 45 | 274.344 | 2 | ↓ |
Hi High (pH 8-9.5) | 0.71 | 4.08 | -15.16 | 0 | 5 | 0 | 44 | 273.336 | 2 | ↓ |