In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 23rd, 2011 | 18 | Yes |
Popular Name: N-[(4-chlorothieno[2,3-d]pyrimidin-2-yl)methyl]-3-methoxy-N-methyl-propan-1-amine N-[(4-chlorothieno[2,3-d]pyrimid…
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) | 2.26 | 3.65 | -7.71 | 0 | 4 | 0 | 38 | 285.8 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.26 | 5.98 | -36.65 | 1 | 4 | 1 | 39 | 286.808 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.