In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 26th, 2011 | 19 | Yes |
Popular Name: 4-(4-cyclopropyl-1,4-diazepan-1-yl)thieno[2,3-d]pyrimidine 4-(4-cyclopropyl-1,4-diazepan-1-…
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) | 2.05 | 9.58 | -36.47 | 1 | 4 | 1 | 33 | 275.401 | 2 | ↓ |
Hi High (pH 8-9.5) | 2.05 | 7.54 | -6.23 | 0 | 4 | 0 | 32 | 274.393 | 2 | ↓ |