In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 29th, 2008 | 23 | No |
Popular Name: 5-bromo-3-[N'-[5-(trifluoromethyl)-2-pyridyl]hydrazino]indol-2-one 5-bromo-3-[N'-[5-(trifluoromethy…
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) | 4.24 | 3.57 | -9.91 | 2 | 5 | 0 | 70 | 385.143 | 3 | ↓ |
Ref Reference (pH 7) | 3.78 | 6.12 | -13.1 | 2 | 5 | 0 | 70 | 385.143 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.97 | 5.02 | -41.71 | 1 | 5 | -1 | 76 | 384.135 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.97 | 5 | -42.13 | 1 | 5 | -1 | 76 | 384.135 | 3 | ↓ |
Hi High (pH 8-9.5) | 4.24 | 4.09 | -48.85 | 1 | 5 | -1 | 73 | 384.135 | 3 | ↓ |