In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 16 | Yes |
Popular Name: (1S)-1-(3-bromo-2-thienyl)-N-(cyclohexylmethyl)ethanamine (1S)-1-(3-bromo-2-thienyl)-N-(cy…
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) | 4.98 | 8.73 | -36.16 | 2 | 1 | 1 | 17 | 303.289 | 4 | ↓ |
Hi High (pH 8-9.5) | 4.98 | 7.52 | -1.5 | 1 | 1 | 0 | 12 | 302.281 | 4 | ↓ |