In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 20 | Yes |
Popular Name: (1S)-2,2-dimethyl-1-phenyl-N-[(1S)-1-(2-thienyl)propyl]propan-1-amine (1S)-2,2-dimethyl-1-phenyl-N-[(1…
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) | 5.74 | 10.96 | -29.37 | 2 | 1 | 1 | 17 | 288.48 | 6 | ↓ |
Hi High (pH 8-9.5) | 5.74 | 10.44 | -1.56 | 1 | 1 | 0 | 12 | 287.472 | 6 | ↓ |