In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 25th, 2008 | 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) | 1.16 | 3.17 | -43.43 | 3 | 3 | 1 | 34 | 260.405 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 5.36 | -108.93 | 4 | 3 | 2 | 35 | 261.413 | 3 | ↓ |
Lo Low (pH 4.5-6) | 1.16 | 7.69 | -199.21 | 5 | 3 | 3 | 37 | 262.421 | 3 | ↓ |