In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
February 26th, 2009 | 19 | No |
Popular Name: 4-[(1R,2S,4S)-norbornan-2-yl]-5-phenyl-1,2,4-triazole-3-thiol 4-[(1R,2S,4S)-norbornan-2-yl]-5-…
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) | 3.10 | 9.62 | -9.4 | 1 | 3 | 0 | 34 | 271.389 | 2 | ↓ |
Mid Mid (pH 6-8) | 3.82 | 9.46 | -43.8 | 0 | 3 | -1 | 31 | 270.381 | 2 | ↓ |