In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 26th, 2009 | 11 | Yes |
Popular Name: (2S)-N1-(1-ethylpropyl)-N1-methyl-propane-1,2-diamine (2S)-N1-(1-ethylpropyl)-N1-methy…
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) | 1.29 | 4.05 | -111.27 | 4 | 2 | 2 | 32 | 160.305 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 2.56 | -36.28 | 3 | 2 | 1 | 31 | 159.297 | 5 | ↓ |
Mid Mid (pH 6-8) | 1.29 | 3.74 | -28.61 | 3 | 2 | 1 | 30 | 159.297 | 5 | ↓ |