In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 10th, 2009 | 23 | 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) | 3.81 | 7.13 | -15.44 | 2 | 4 | 0 | 62 | 306.365 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.81 | 7.49 | -38.93 | 3 | 4 | 1 | 63 | 307.373 | 4 | ↓ |