In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2004 | 32 | Yes |
Popular Name: 3-[(4-keto-5-tetralin-6-yl-1H-thieno[2,3-d]pyrimidin-2-yl)thio]-N-phenyl-propionamide 3-[(4-keto-5-tetralin-6-yl-1H-th…
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) | 6.20 | 11.56 | -27.76 | 2 | 5 | 0 | 75 | 461.612 | 6 | ↓ |
Hi High (pH 8-9.5) | 6.66 | 10.32 | -60.2 | 1 | 5 | -1 | 78 | 460.604 | 6 | ↓ |