In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2005 | 37 | No |
Popular Name: N-(cyanoBLAHyl)-2-(N,N-diphenylcarbamimidoyl)sulfanyl-acetamide N-(cyanoBLAHyl)-2-(N,N-diphenylc…
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) | 6.58 | 16.69 | -11.19 | 2 | 5 | 0 | 80 | 506.675 | 7 | ↓ |
Mid Mid (pH 6-8) | 6.58 | 16.71 | -35.52 | 3 | 5 | 1 | 82 | 507.683 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.