In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 30th, 2010 | 20 | Yes |
Popular Name: (1R,2S)-N2-[(1R)-1,3-dimethylbutyl]-N2,3-dimethyl-1-phenyl-butane-1,2-diamine (1R,2S)-N2-[(1R)-1,3-dimethylbut…
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) | 2.55 | 8.75 | -28.53 | 3 | 2 | 1 | 30 | 277.476 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.55 | 8.37 | -105.9 | 4 | 2 | 2 | 32 | 278.484 | 7 | ↓ |