In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 19th, 2011 | 24 | Yes |
Popular Name: N,N-dimethyl-4-[(5-phenyl-6,7-dihydropyrrolo[3,2-d]pyrimidin-2-yl)amino]butanamide N,N-dimethyl-4-[(5-phenyl-6,7-di…
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) | 2.29 | 9.52 | -12.76 | 1 | 6 | 0 | 61 | 325.416 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.29 | 9.91 | -35.59 | 2 | 6 | 1 | 63 | 326.424 | 6 | ↓ |
No pre-computed analogs available. Try a structural similarity search.