In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 25th, 2009 | 22 | 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) | 3.16 | 10.29 | -49.39 | 0 | 4 | -1 | 60 | 302.394 | 6 | ↓ |
Lo Low (pH 4.5-6) | 3.16 | 9.17 | -9.61 | 1 | 4 | 0 | 58 | 303.402 | 6 | ↓ |