In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 6th, 2007 | 27 | 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) | 2.93 | -1.19 | -19.08 | 1 | 7 | 0 | 85 | 361.405 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.93 | -1.01 | -39.85 | 2 | 7 | 1 | 87 | 362.413 | 4 | ↓ |