In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 4th, 2009 | 22 | Yes |
Popular Name: (3aR,9bR)-2-benzyl-3,3a,4,9b-tetrahydro-1H-chromeno[4,3-c]pyrrole-7-carbonitrile (3aR,9bR)-2-benzyl-3,3a,4,9b-tet…
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) | 3.17 | 7.2 | -6.2 | 0 | 3 | 0 | 36 | 290.366 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.17 | 9.67 | -55.49 | 1 | 3 | 1 | 37 | 291.374 | 2 | ↓ |