In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2010 | 21 | Yes |
Popular Name: 4-chloro-2-(4-pyridylmethyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidine 4-chloro-2-(4-pyridylmethyl)-5,6…
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) | 4.05 | 8.52 | -7.36 | 0 | 3 | 0 | 39 | 315.829 | 2 | ↓ |
Lo Low (pH 4.5-6) | 4.05 | 8.98 | -33.9 | 1 | 3 | 1 | 40 | 316.837 | 2 | ↓ |