In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 18 | Yes |
Popular Name: N1-[(3R)-1-isopropylpyrrolidin-3-yl]-N2,N2-dimethyl-benzene-1,2-diamine N1-[(3R)-1-isopropylpyrrolidin-3…
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) | 3.34 | 8.27 | -34.57 | 2 | 3 | 1 | 20 | 248.394 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.34 | 5.92 | -1.84 | 1 | 3 | 0 | 19 | 247.386 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.34 | 8.51 | -85.18 | 3 | 3 | 2 | 21 | 249.402 | 4 | ↓ |