In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 21st, 2010 | 16 | Yes |
Popular Name: (2R,3R)-N2-cyclopropyl-N3-methyl-N2-(2,2,2-trifluoroethyl)pentane-2,3-diamine (2R,3R)-N2-cyclopropyl-N3-methyl…
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) | 2.61 | 5.91 | -35.87 | 2 | 2 | 1 | 20 | 239.305 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.61 | 3.75 | -1.78 | 1 | 2 | 0 | 15 | 238.297 | 7 | ↓ |
Lo Low (pH 4.5-6) | 2.61 | 6.28 | -100.53 | 3 | 2 | 2 | 21 | 240.313 | 7 | ↓ |