In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2009 | 26 | Yes |
Popular Name: 4-tert-butyl-N-(3-cyano-6-ethyl-5,7-dihydro-4H-thieno[2,3-c]pyridin-2-yl)benzamide 4-tert-butyl-N-(3-cyano-6-ethyl-…
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) | 4.39 | 11.38 | -42.27 | 2 | 4 | 1 | 57 | 368.526 | 4 | ↓ |
Mid Mid (pH 6-8) | 4.39 | 9.11 | -6.14 | 1 | 4 | 0 | 56 | 367.518 | 4 | ↓ |