In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 14 | Yes |
Popular Name: (2S,3S)-N3-(2-methoxyethyl)-N3-methyl-N2-propyl-butane-2,3-diamine (2S,3S)-N3-(2-methoxyethyl)-N3-m…
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) | 1.65 | 3.32 | -35.06 | 2 | 3 | 1 | 29 | 203.35 | 8 | ↓ |
Hi High (pH 8-9.5) | 1.65 | 2.25 | -1.7 | 1 | 3 | 0 | 24 | 202.342 | 8 | ↓ |
Mid Mid (pH 6-8) | 1.65 | 4.22 | -29.05 | 2 | 3 | 1 | 26 | 203.35 | 8 | ↓ |