In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2010 | 22 | Yes |
Popular Name: (3aS,9bR)-2-benzyl-3,3a,4,9b-tetrahydro-1H-chromeno[3,4-c]pyrrole-7-carbonitrile (3aS,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 | 8.01 | -7.03 | 0 | 3 | 0 | 36 | 290.366 | 2 | ↓ |
Lo Low (pH 4.5-6) | 3.17 | 10.38 | -52.2 | 1 | 3 | 1 | 37 | 291.374 | 2 | ↓ |