In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 15th, 2011 | 21 | Yes |
Popular Name: (1R)-N'-(6-ethylthieno[2,3-d]pyrimidin-4-yl)-1-phenyl-ethane-1,2-diamine (1R)-N'-(6-ethylthieno[2,3-d]pyr…
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) | 1.19 | 7.63 | -56.41 | 4 | 4 | 1 | 65 | 299.423 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.19 | 7.26 | -8.21 | 3 | 4 | 0 | 64 | 298.415 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.