In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 21 | 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) | -0.24 | 4.71 | -23.56 | 1 | 6 | 0 | 77 | 306.391 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.24 | 4.7 | -61.5 | 2 | 6 | 1 | 81 | 307.399 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.