In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 3rd, 2007 | 27 | Yes |
Popular Name: 7-benzoylamino-N-(4-pyridylmethyl)-6-thia-8-azabicyclo[3.3.0]octa-7,9-diene-2-carboxamide 7-benzoylamino-N-(4-pyridylmethy…
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) | 1.86 | -3.74 | -13.34 | 2 | 6 | 0 | 83 | 378.457 | 5 | ↓ |
Lo Low (pH 4.5-6) | 1.86 | -3.63 | -47.25 | 3 | 6 | 1 | 85 | 379.465 | 5 | ↓ |