In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 14 | Yes |
Popular Name: (3R)-N1-[(1S)-1,2-dimethylpropyl]-N3-ethyl-N1-methyl-butane-1,3-diamine (3R)-N1-[(1S)-1,2-dimethylpropyl…
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) | 2.56 | 7.25 | -99.96 | 3 | 2 | 2 | 21 | 202.386 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.56 | 6.06 | -31.94 | 2 | 2 | 1 | 16 | 201.378 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.56 | 5.47 | -33.56 | 2 | 2 | 1 | 20 | 201.378 | 7 | ↓ |