In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: (1S)-3,3-dimethyl-N-[(1R)-1-(5-methyl-2-thienyl)ethyl]-1-phenyl-butan-1-amine (1S)-3,3-dimethyl-N-[(1R)-1-(5-m…
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) | 4.83 | 11.2 | -34.6 | 2 | 1 | 1 | 17 | 302.507 | 6 | ↓ |
Hi High (pH 8-9.5) | 4.83 | 10.07 | -3.27 | 1 | 1 | 0 | 12 | 301.499 | 6 | ↓ |