In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 24th, 2009 | 17 | 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) | 1.95 | 6.28 | -33.91 | 1 | 3 | 1 | 25 | 253.391 | 4 | ↓ |
Mid Mid (pH 6-8) | 1.95 | 4.06 | -6.85 | 0 | 3 | 0 | 24 | 252.383 | 4 | ↓ |