In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 9th, 2009 | 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) | 0.62 | 6.97 | -15.76 | 0 | 8 | 0 | 72 | 395.511 | 4 | ↓ |
Mid Mid (pH 6-8) | 0.62 | 9.24 | -59.01 | 1 | 8 | 1 | 73 | 396.519 | 4 | ↓ |