In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 20th, 2011 | 19 | Yes |
Popular Name: (2R)-2-cyclopropyl-2-(isopropylamino)-3-pyrimidin-4-ylsulfanyl-propanamide (2R)-2-cyclopropyl-2-(isopropyla…
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) | 0.85 | 4.21 | -41.1 | 4 | 5 | 1 | 85 | 281.405 | 7 | ↓ |
Hi High (pH 8-9.5) | 0.85 | 2.81 | -8.51 | 3 | 5 | 0 | 81 | 280.397 | 7 | ↓ |
No pre-computed analogs available. Try a structural similarity search.