In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2009 | 33 | Yes |
Popular Name: 5-[2-[3-(3-morpholinopropyl)anilino]pyrimidin-4-yl]-N-prop-2-ynyl-thiophene-2-carboxamide 5-[2-[3-(3-morpholinopropyl)anil…
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) | 3.92 | 10.08 | -12.28 | 2 | 7 | 0 | 79 | 461.591 | 9 | ↓ |
Mid Mid (pH 6-8) | 3.92 | 12.34 | -46.95 | 3 | 7 | 1 | 81 | 462.599 | 9 | ↓ |