In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 28th, 2010 | 12 | Yes |
Popular Name: N,N'-dimethyl-N-[(1S)-1-methylbutyl]propane-1,3-diamine N,N'-dimethyl-N-[(1S)-1-methylbu…
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) | 2.17 | 6 | -96.32 | 3 | 2 | 2 | 21 | 174.332 | 7 | ↓ |
Hi High (pH 8-9.5) | 2.17 | 4.56 | -31.3 | 2 | 2 | 1 | 16 | 173.324 | 7 | ↓ |
Mid Mid (pH 6-8) | 2.17 | 4.08 | -36.19 | 2 | 2 | 1 | 20 | 173.324 | 7 | ↓ |