In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 15 | Yes |
Popular Name: (1R,2S)-N1-isopropyl-N1-(2,2,2-trifluoroethyl)cyclopentane-1,2-diamine (1R,2S)-N1-isopropyl-N1-(2,2,2-t…
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) | 1.70 | 3.91 | -37.23 | 3 | 2 | 1 | 31 | 225.278 | 4 | ↓ |
Lo Low (pH 4.5-6) | 1.70 | 5.15 | -111.52 | 4 | 2 | 2 | 32 | 226.286 | 4 | ↓ |