In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 20 | Yes |
Popular Name: N2,N2,2-trimethyl-N1-[(2-pyrrolidin-1-ylphenyl)methyl]propane-1,2-diamine N2,N2,2-trimethyl-N1-[(2-pyrroli…
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) | 2.79 | 8.99 | -32.78 | 2 | 3 | 1 | 20 | 276.448 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.79 | 7.91 | -33.63 | 2 | 3 | 1 | 23 | 276.448 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.79 | 10.03 | -112.04 | 3 | 3 | 2 | 24 | 277.456 | 6 | ↓ |