In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 21 | Yes |
Popular Name: 3-cyclopropyl-2-(ethylaminomethyl)-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-one 3-cyclopropyl-2-(ethylaminomethy…
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) | 2.39 | 8.75 | -52.96 | 2 | 4 | 1 | 52 | 304.439 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.39 | 7.33 | -10.91 | 1 | 4 | 0 | 47 | 303.431 | 4 | ↓ |