In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 19 | Yes |
Popular Name: (2S)-3-phenyl-N1-(1,1,3,3-tetramethylbutyl)propane-1,2-diamine (2S)-3-phenyl-N1-(1,1,3,3-tetram…
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) | 3.55 | 7.94 | -31.32 | 4 | 2 | 1 | 43 | 263.449 | 7 | ↓ |
Mid Mid (pH 6-8) | 3.55 | 8.36 | -123.71 | 5 | 2 | 2 | 44 | 264.457 | 7 | ↓ |