In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 27th, 2010 | 25 | 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) | 1.60 | 9.17 | -39.8 | 2 | 5 | 1 | 54 | 362.519 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.60 | 7.01 | -10.64 | 1 | 5 | 0 | 53 | 361.511 | 7 | ↓ |