In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 25th, 2010 | 12 | Yes |
Popular Name: (2S)-N1-(2,2-dimethylpropyl)-N1,N2-dimethyl-propane-1,2-diamine (2S)-N1-(2,2-dimethylpropyl)-N1,…
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) | 2.16 | 6 | -107.66 | 3 | 2 | 2 | 21 | 174.332 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.16 | 4.65 | -31.71 | 2 | 2 | 1 | 16 | 173.324 | 5 | ↓ |
Mid Mid (pH 6-8) | 2.16 | 5.08 | -31.85 | 2 | 2 | 1 | 20 | 173.324 | 5 | ↓ |