In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2010 | 30 | Yes |
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) | 2.70 | 3.49 | -69.13 | 2 | 8 | -1 | 116 | 407.402 | 5 | ↓ |
Ref Reference (pH 7) | 2.51 | 6.13 | -62.29 | 2 | 8 | -1 | 113 | 407.402 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.