In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 29 | Yes |
Popular Name: 4-[[[4-keto-5-(p-tolyl)-1H-thieno[2,3-d]pyrimidin-2-yl]thio]methyl]benzoic-acid-methyl-ester 4-[[[4-keto-5-(p-tolyl)-1H-thien…
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) | 6.16 | 11.34 | -19.62 | 1 | 5 | 0 | 72 | 422.531 | 6 | ↓ |
Mid Mid (pH 6-8) | 6.61 | 10.1 | -48.19 | 0 | 5 | -1 | 75 | 421.523 | 6 | ↓ |