In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 28th, 2008 | 27 | 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) | 2.99 | 6.32 | -16.37 | 1 | 5 | 0 | 62 | 383.517 | 5 | ↓ |
Lo Low (pH 4.5-6) | 2.99 | 6.76 | -38.9 | 2 | 5 | 1 | 64 | 384.525 | 5 | ↓ |