In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 7th, 2009 | 23 | 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) | 3.67 | 5.21 | -20.9 | 3 | 5 | 0 | 78 | 312.369 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.67 | 6.24 | -66.64 | 2 | 5 | -1 | 81 | 311.361 | 4 | ↓ |