In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2005 | 27 | Yes |
Popular Name: N-benzyl-2-[(8-phenyl-5,6,9-triazabicyclo[4.3.0]nona-2,4,7,9-tetraen-4-yl)sulfanyl]acetamide N-benzyl-2-[(8-phenyl-5,6,9-tria…
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) | 3.69 | 10.24 | -12.95 | 1 | 5 | 0 | 59 | 374.469 | 6 | ↓ |
Mid Mid (pH 6-8) | 3.69 | 10.67 | -33.6 | 2 | 5 | 1 | 61 | 375.477 | 6 | ↓ |