In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 19th, 2011 | 30 | No |
Popular Name: comazaphilone B comazaphilone B
None
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) | 2.98 | 4.77 | -22.89 | 3 | 8 | 0 | 123 | 418.442 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.98 | 5.69 | -61.22 | 2 | 8 | -1 | 125 | 417.434 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.