In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 23rd, 2009 | 20 | Yes |
Popular Name: (1R)-1-(3-bromophenyl)-N-[(1-tert-butylpyrazol-4-yl)methyl]ethanamine (1R)-1-(3-bromophenyl)-N-[(1-ter…
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) | 3.80 | 9.3 | -45.03 | 2 | 3 | 1 | 34 | 337.285 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.80 | 8.2 | -5.28 | 1 | 3 | 0 | 30 | 336.277 | 5 | ↓ |