In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 20th, 2009 | 16 | Yes |
Popular Name: (2R)-N2-ethyl-N2-[(1S)-1-methylpropyl]octane-1,2-diamine (2R)-N2-ethyl-N2-[(1S)-1-methylp…
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) | 3.67 | 6.26 | -41.56 | 3 | 2 | 1 | 31 | 229.432 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 7.44 | -26.36 | 3 | 2 | 1 | 30 | 229.432 | 10 | ↓ |
Mid Mid (pH 6-8) | 3.67 | 6.91 | -115.43 | 4 | 2 | 2 | 32 | 230.44 | 10 | ↓ |