In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 16th, 2008 | 20 | Yes |
Popular Name: (4R)-N'-[(1S)-1-(2,5-dimethylthiazol-4-yl)ethyl]-N,N-diethyl-pentane-1,4-diamine (4R)-N'-[(1S)-1-(2,5-dimethylthi…
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) | 2.81 | 9.6 | -89.47 | 3 | 3 | 2 | 34 | 299.528 | 9 | ↓ |
Hi High (pH 8-9.5) | 2.81 | 8.32 | -31.15 | 2 | 3 | 1 | 29 | 298.52 | 9 | ↓ |