In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 23rd, 2010 | 15 | Yes |
Popular Name: (1S,2S)-N1-[6-(trifluoromethyl)-2-pyridyl]cyclopropane-1,2-diamine (1S,2S)-N1-[6-(trifluoromethyl)-…
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) | 1.37 | 2.4 | -51.81 | 4 | 3 | 1 | 53 | 218.202 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.37 | 2.08 | -5.61 | 3 | 3 | 0 | 51 | 217.194 | 3 | ↓ |