In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 20 | Yes |
Popular Name: N-[(4-chloro-5,6-dimethyl-thieno[2,3-d]pyrimidin-2-yl)methyl]-N-propyl-cyclopropanamine N-[(4-chloro-5,6-dimethyl-thieno…
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) | 3.85 | 9.08 | -31.82 | 1 | 3 | 1 | 30 | 310.874 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.85 | 7.15 | -5.66 | 0 | 3 | 0 | 29 | 309.866 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.