In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 23 | Yes |
Popular Name: 5-phenyl-N-(2-pyrrolidin-1-ylethyl)-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-amine 5-phenyl-N-(2-pyrrolidin-1-yleth…
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) | 3.27 | 10.93 | -36.46 | 2 | 5 | 1 | 45 | 310.425 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.27 | 8.49 | -6.84 | 1 | 5 | 0 | 44 | 309.417 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.27 | 11.34 | -89.76 | 3 | 5 | 2 | 47 | 311.433 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.