In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 7th, 2006 | 29 | 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) | 3.53 | 10.26 | -17.86 | 1 | 7 | 0 | 89 | 396.491 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.53 | 10.67 | -31.44 | 2 | 7 | 1 | 91 | 397.499 | 9 | ↓ |