In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
January 28th, 2009 | 29 | Yes |
Popular Name: (4-chlorophenyl)sulfanylmethyl-N-(4-pyridylmethyl)BLAHamine (4-chlorophenyl)sulfanylmethyl-N…
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) | 4.86 | 12.52 | -10.5 | 1 | 4 | 0 | 51 | 439.009 | 6 | ↓ |
Lo Low (pH 4.5-6) | 4.86 | 12.96 | -48.51 | 2 | 4 | 1 | 52 | 440.017 | 6 | ↓ |