In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 20th, 2010 | 16 | Yes |
Popular Name: (3S)-N3-ethyl-N1,N1-bis(2-methoxyethyl)butane-1,3-diamine (3S)-N3-ethyl-N1,N1-bis(2-methox…
None
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) | 1.07 | 4.54 | -101.85 | 3 | 4 | 2 | 40 | 234.384 | 11 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 3.53 | -29.12 | 2 | 4 | 1 | 35 | 233.376 | 11 | ↓ |
Hi High (pH 8-9.5) | 1.07 | 2.38 | -31.98 | 2 | 4 | 1 | 38 | 233.376 | 11 | ↓ |