In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 14th, 2009 | 12 | Yes |
Popular Name: (2S)-N'-[(1R)-1,2-dimethylpropyl]-N',2-dimethyl-propane-1,3-diamine (2S)-N'-[(1R)-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) | 1.35 | 4.64 | -103.42 | 4 | 2 | 2 | 32 | 174.332 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.35 | 3.03 | -39.56 | 3 | 2 | 1 | 31 | 173.324 | 5 | ↓ |
Hi High (pH 8-9.5) | 1.35 | 4.26 | -29.29 | 3 | 2 | 1 | 30 | 173.324 | 5 | ↓ |