In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 18 | Yes |
Popular Name: (3R)-1-isopropyl-N-[(2-methoxyphenyl)methyl]pyrrolidin-3-amine (3R)-1-isopropyl-N-[(2-methoxyph…
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) | 2.33 | 4.98 | -34.84 | 2 | 3 | 1 | 29 | 249.378 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 6.15 | -31.53 | 2 | 3 | 1 | 26 | 249.378 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.33 | 3.79 | -3.47 | 1 | 3 | 0 | 24 | 248.37 | 5 | ↓ |