In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 3rd, 2011 | 18 | No |
Popular Name: (2S)-N2,2-dimethyl-N2-[(1S)-1-methylbutyl]nonane-1,2-diamine (2S)-N2,2-dimethyl-N2-[(1S)-1-me…
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) | 4.81 | 8.47 | -114.72 | 4 | 2 | 2 | 32 | 258.494 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.81 | 8.32 | -27.08 | 3 | 2 | 1 | 30 | 257.486 | 11 | ↓ |
Mid Mid (pH 6-8) | 4.81 | 6.92 | -38.99 | 3 | 2 | 1 | 31 | 257.486 | 11 | ↓ |