In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 21st, 2009 | 21 | Yes |
Popular Name: (3S)-3-[[(1S,3S)-3-(trifluoromethyl)cyclohexyl]amino]indolin-2-one (3S)-3-[[(1S,3S)-3-(trifluoromet…
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) | 3.13 | 6.34 | -40.23 | 3 | 3 | 1 | 46 | 299.316 | 3 | ↓ |
Mid Mid (pH 6-8) | 3.13 | 5.35 | -8.15 | 2 | 3 | 0 | 41 | 298.308 | 3 | ↓ |