In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 20 | Yes |
Popular Name: N1-[(4R)-6,8-dichlorochroman-4-yl]-N2,N2,2-trimethyl-propane-1,2-diamine N1-[(4R)-6,8-dichlorochroman-4-y…
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) | 3.02 | 6.4 | -42.56 | 2 | 3 | 1 | 29 | 318.268 | 4 | ↓ |
Hi High (pH 8-9.5) | 3.02 | 4.38 | -2.71 | 1 | 3 | 0 | 24 | 317.26 | 4 | ↓ |
Mid Mid (pH 6-8) | 3.02 | 6.89 | -36.45 | 2 | 3 | 1 | 26 | 318.268 | 4 | ↓ |
Lo Low (pH 4.5-6) | 3.02 | 8.56 | -123.15 | 3 | 3 | 2 | 30 | 319.276 | 4 | ↓ |