In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2010 | 20 | Yes |
Popular Name: N-[(3R)-1-(5-methyl-7H-pyrrolo[2,3-d]pyrimidin-4-yl)pyrrolidin-3-yl]methanesulfonamide N-[(3R)-1-(5-methyl-7H-pyrrolo[2…
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) | 0.43 | 3.22 | -17.42 | 2 | 7 | 0 | 91 | 295.368 | 3 | ↓ |
Lo Low (pH 4.5-6) | 0.43 | 3.69 | -40.91 | 3 | 7 | 1 | 92 | 296.376 | 3 | ↓ |
No pre-computed analogs available. Try a structural similarity search.