In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 1st, 2006 | 23 | No |
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) | 4.95 | 10.38 | -8.29 | 0 | 4 | 0 | 48 | 311.381 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.95 | 10.04 | -43.45 | 1 | 4 | 1 | 50 | 312.389 | 8 | ↓ |
Lo Low (pH 4.5-6) | 4.95 | 10.72 | -40.85 | 1 | 4 | 1 | 50 | 312.389 | 8 | ↓ |