In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 2nd, 2009 | 21 | Yes |
Popular Name: (2S)-2-ethyl-N-[(5-phenyl-2-thienyl)methyl]hexan-1-amine (2S)-2-ethyl-N-[(5-phenyl-2-thie…
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) | 6.51 | 12.4 | -42.26 | 2 | 1 | 1 | 17 | 302.507 | 9 | ↓ |
Hi High (pH 8-9.5) | 6.51 | 11.04 | -2.96 | 1 | 1 | 0 | 12 | 301.499 | 9 | ↓ |