In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: (3S)-1-isopropyl-N-[(2-methylpyrimidin-4-yl)methyl]pyrrolidin-3-amine (3S)-1-isopropyl-N-[(2-methylpyr…
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) | 0.72 | 4.74 | -36.1 | 2 | 4 | 1 | 42 | 235.355 | 4 | ↓ |
Hi High (pH 8-9.5) | 0.72 | 2.41 | -5.9 | 1 | 4 | 0 | 41 | 234.347 | 4 | ↓ |