In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 24th, 2009 | 25 | Yes |
Popular Name: 4-[5-[[[(1S)-1-methylpropyl]-(2-thienylmethyl)amino]methyl]-2-furyl]heptan-4-ol 4-[5-[[[(1S)-1-methylpropyl]-(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) | 6.02 | 10.65 | -35.02 | 2 | 3 | 1 | 38 | 364.575 | 11 | ↓ |
Hi High (pH 8-9.5) | 6.02 | 9.38 | -3.58 | 1 | 3 | 0 | 37 | 363.567 | 11 | ↓ |