In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 16 | Yes |
Popular Name: (1R,2S)-N2-methyl-N1-propyl-N1-(2,2,2-trifluoroethyl)cyclopentane-1,2-diamine (1R,2S)-N2-methyl-N1-propyl-N1-(…
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) | 2.81 | 6.02 | -32.87 | 2 | 2 | 1 | 20 | 239.305 | 6 | ↓ |
Lo Low (pH 4.5-6) | 2.81 | 7.41 | -107.75 | 3 | 2 | 2 | 21 | 240.313 | 6 | ↓ |