In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 5th, 2009 | 21 | Yes |
Popular Name: (2R)-N2,N2,3-trimethyl-N1-[(2-pyrrolidin-1-ylphenyl)methyl]butane-1,2-diamine (2R)-N2,N2,3-trimethyl-N1-[(2-py…
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) | 3.09 | 10.42 | -32.13 | 2 | 3 | 1 | 20 | 290.475 | 7 | ↓ |
Hi High (pH 8-9.5) | 3.09 | 8.34 | -34.55 | 2 | 3 | 1 | 23 | 290.475 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.09 | 11.25 | -119.93 | 3 | 3 | 2 | 24 | 291.483 | 7 | ↓ |