In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 15th, 2013 | 19 | No |
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) | -3.23 | -10.64 | -140.7 | 4 | 10 | -2 | 175 | 299.172 | 4 | ↓ |
Mid Mid (pH 6-8) | -3.23 | -12.01 | -54.88 | 5 | 10 | -1 | 172 | 300.18 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.