In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 4th, 2010 | 16 | Yes |
Popular Name: (2S)-N1-isopropyl-2-methyl-N1-(2,2,2-trifluoroethyl)pentane-1,2-diamine (2S)-N1-isopropyl-2-methyl-N1-(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) | 3.22 | 4.48 | -39.7 | 3 | 2 | 1 | 31 | 241.321 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.22 | 5.94 | -116.59 | 4 | 2 | 2 | 32 | 242.329 | 7 | ↓ |