In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 31st, 2004 | 33 | Yes |
Popular Name: (2S)-2-[(4-keto-5-tetralin-6-yl-1H-thieno[2,3-d]pyrimidin-2-yl)thio]-N-(p-tolyl)propionamide (2S)-2-[(4-keto-5-tetralin-6-yl-…
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) | 6.74 | 12.59 | -17.6 | 2 | 5 | 0 | 75 | 475.639 | 5 | ↓ |
Hi High (pH 8-9.5) | 7.20 | 11.34 | -49.11 | 1 | 5 | -1 | 78 | 474.631 | 5 | ↓ |