In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 24th, 2011 | 20 | No |
Popular Name: (2S)-3-ethyl-N2,N2-dimethyl-N1-[(1R)-1-methyloctyl]pentane-1,2-diamine (2S)-3-ethyl-N2,N2-dimethyl-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) | 6.03 | 11.49 | -115.95 | 3 | 2 | 2 | 21 | 286.548 | 13 | ↓ |
Hi High (pH 8-9.5) | 6.03 | 11.62 | -30.97 | 2 | 2 | 1 | 16 | 285.54 | 13 | ↓ |
Mid Mid (pH 6-8) | 6.03 | 9.97 | -32.94 | 2 | 2 | 1 | 20 | 285.54 | 13 | ↓ |