In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 16 | Yes |
Popular Name: (2S,3R)-N2,N3-dimethyl-N2-(o-tolylmethyl)butane-2,3-diamine (2S,3R)-N2,N3-dimethyl-N2-(o-tol…
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) | 2.59 | 7.84 | -106.89 | 3 | 2 | 2 | 21 | 222.376 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.59 | 6.86 | -31.41 | 2 | 2 | 1 | 16 | 221.368 | 5 | ↓ |