In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 10th, 2011 | 41 | No |
Popular Name: C17775; Gambiriin B1 C17775; Gambiriin B1
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) | 3.44 | -7.48 | -20.06 | 9 | 11 | 0 | 201 | 562.527 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.44 | -6.57 | -59.58 | 8 | 11 | -1 | 203 | 561.519 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.