In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 17 | Yes |
Popular Name: (2R,3R)-N3-(2-dimethylaminoethyl)-4,4-dimethyl-N3-propyl-pentane-2,3-diamine (2R,3R)-N3-(2-dimethylaminoethyl…
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) | 2.15 | 4.89 | -100.66 | 4 | 3 | 2 | 35 | 245.455 | 8 | ↓ |
Hi High (pH 8-9.5) | 2.15 | 2.42 | -38.04 | 3 | 3 | 1 | 34 | 244.447 | 8 | ↓ |
Lo Low (pH 4.5-6) | 2.15 | 6.91 | -217.06 | 5 | 3 | 3 | 37 | 246.463 | 8 | ↓ |