In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 29th, 2009 | 17 | Yes |
Popular Name: (1S)-N-methyl-1-(o-tolyl)-N-(2,2,2-trifluoroethyl)ethane-1,2-diamine (1S)-N-methyl-1-(o-tolyl)-N-(2,2…
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) | 2.06 | 4.16 | -51.55 | 3 | 2 | 1 | 31 | 247.284 | 5 | ↓ |
Hi High (pH 8-9.5) | 2.06 | 3.9 | -4.48 | 2 | 2 | 0 | 29 | 246.276 | 5 | ↓ |