In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 17th, 2010 | 20 | Yes |
Popular Name: N-[(S)-(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)-thiazol-2-yl-methyl]ethanamine N-[(S)-(5-chloro-2,3-dihydro-1,4…
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) | 2.62 | 5.72 | -39.59 | 2 | 4 | 1 | 48 | 311.814 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.62 | 4.61 | -8.05 | 1 | 4 | 0 | 43 | 310.806 | 4 | ↓ |