In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 8th, 2010 | 18 | Yes |
Popular Name: N-[(2-cyclopentyl-6-methyl-pyrimidin-4-yl)methyl]-2-methyl-propan-1-amine N-[(2-cyclopentyl-6-methyl-pyrim…
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) | 2.86 | 7.74 | -40.97 | 2 | 3 | 1 | 42 | 248.394 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.86 | 6.52 | -5.26 | 1 | 3 | 0 | 38 | 247.386 | 5 | ↓ |
No pre-computed analogs available. Try a structural similarity search.