In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 21st, 2009 | 21 | Yes |
Popular Name: (1S)-2-[(5-bromo-2-thienyl)methylamino]-1-[3-(trifluoromethyl)phenyl]ethanol (1S)-2-[(5-bromo-2-thienyl)methy…
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) | 4.01 | 5.42 | -5.93 | 2 | 2 | 0 | 32 | 380.229 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.01 | 6.76 | -52.04 | 3 | 2 | 1 | 37 | 381.237 | 6 | ↓ |