In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 10th, 2010 | 16 | Yes |
Popular Name: (2R)-N-[(5-chloro-2-thienyl)methyl]-N'-ethyl-N,2-dimethyl-propane-1,3-diamine (2R)-N-[(5-chloro-2-thienyl)meth…
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) | 3.00 | 6.38 | -38.65 | 2 | 2 | 1 | 20 | 261.842 | 7 | ↓ |
Lo Low (pH 4.5-6) | 3.00 | 8.44 | -105.84 | 3 | 2 | 2 | 21 | 262.85 | 7 | ↓ |