In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 18 | 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) | 4.83 | 7.9 | -10.62 | 0 | 2 | 0 | 40 | 302.147 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.64 | 10.59 | -18.44 | 0 | 2 | 0 | 34 | 303.155 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.