In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
October 8th, 2009 | 19 | Yes |
Popular Name: (1S)-1-(2,5-dibromo-3-thienyl)-1-indan-5-yl-N-methyl-methanamine (1S)-1-(2,5-dibromo-3-thienyl)-1…
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) | 5.15 | 10.29 | -39.35 | 2 | 1 | 1 | 17 | 402.175 | 3 | ↓ |
Hi High (pH 8-9.5) | 5.15 | 9.44 | -1.84 | 1 | 1 | 0 | 12 | 401.167 | 3 | ↓ |