In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 19 | 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) | 1.44 | 3.43 | -9.28 | 2 | 5 | 0 | 78 | 252.277 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.44 | 3.88 | -36.73 | 3 | 5 | 1 | 79 | 253.285 | 3 | ↓ |