In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
March 20th, 2010 | 36 | No |
Popular Name: N-[4-[(2R)-2-methylindolin-1-yl]sulfonylphenyl]-4-phenethyl-piperazine-1-carbothioamide N-[4-[(2R)-2-methylindolin-1-yl]…
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) | 4.62 | 14.82 | -64.23 | 2 | 6 | 1 | 57 | 521.732 | 8 | ↓ |
Mid Mid (pH 6-8) | 4.62 | 12.62 | -17.16 | 1 | 6 | 0 | 56 | 520.724 | 8 | ↓ |