In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 16th, 2006 | 31 | Yes |
Popular Name: N-(3-bromophenyl)-2-{[3-cyano-6-phenyl-4-(2-thienyl)-2-pyridinyl]sulfanyl}acetamide N-(3-bromophenyl)-2-{[3-cyano-6-…
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) | 6.33 | -0.39 | -17.27 | 1 | 4 | 0 | 65 | 506.45 | 6 | ↓ |
Lo Low (pH 4.5-6) | 6.33 | -0.2 | -48.95 | 2 | 4 | 1 | 67 | 507.458 | 6 | ↓ |