In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 2nd, 2010 | 20 | Yes |
Popular Name: N-[[(1S)-cyclohex-3-en-1-yl]methyl]-4-(methylaminomethyl)benzenesulfonamide N-[[(1S)-cyclohex-3-en-1-yl]meth…
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) | 2.37 | 4.68 | -52.64 | 3 | 4 | 1 | 63 | 295.428 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 3.24 | -8.3 | 2 | 4 | 0 | 58 | 294.42 | 6 | ↓ |