In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 15 | Yes |
Popular Name: (2S)-N1-ethyl-N2-methyl-N2-[[(2S)-tetrahydrofuran-2-yl]methyl]butane-1,2-diamine (2S)-N1-ethyl-N2-methyl-N2-[[(2S…
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) | 1.39 | 3.88 | -30.73 | 2 | 3 | 1 | 29 | 215.361 | 7 | ↓ |
Hi High (pH 8-9.5) | 1.39 | 2.51 | -2.01 | 1 | 3 | 0 | 24 | 214.353 | 7 | ↓ |
Mid Mid (pH 6-8) | 1.39 | 5.62 | -106.07 | 3 | 3 | 2 | 30 | 216.369 | 7 | ↓ |