In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: (1R)-N-[(1-tert-butylpyrazol-4-yl)methyl]-1-(3,4-dichlorophenyl)ethanamine (1R)-N-[(1-tert-butylpyrazol-4-y…
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) | 4.30 | 9.65 | -49.39 | 2 | 3 | 1 | 34 | 327.279 | 5 | ↓ |
Hi High (pH 8-9.5) | 4.30 | 8.55 | -5.95 | 1 | 3 | 0 | 30 | 326.271 | 5 | ↓ |