In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 18th, 2009 | 22 | Yes |
Popular Name: 2-[(cyclopentylamino)methyl]-3-cyclopropyl-5,6-dimethyl-thieno[2,3-d]pyrimidin-4-one 2-[(cyclopentylamino)methyl]-3-c…
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) | 2.84 | 9.64 | -53.95 | 2 | 4 | 1 | 52 | 318.466 | 4 | ↓ |
Hi High (pH 8-9.5) | 2.84 | 8.35 | -10.96 | 1 | 4 | 0 | 47 | 317.458 | 4 | ↓ |