In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 17 | Yes |
Popular Name: (1R,5R,6S)-N-[(1S)-2-methyl-1-(2-thienyl)propyl]bicyclo[3.2.0]hept-3-en-6-amine (1R,5R,6S)-N-[(1S)-2-methyl-1-(2…
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) | 4.21 | 8.92 | -34.66 | 2 | 1 | 1 | 17 | 248.415 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.21 | 7.49 | -1.7 | 1 | 1 | 0 | 12 | 247.407 | 4 | ↓ |