In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
September 30th, 2010 | 25 | Yes |
Popular Name: N-[(2S)-2-(4-fluorophenyl)-2-(4-methylpiperazin-1-yl)ethyl]-4-methyl-thiophene-2-carboxamide N-[(2S)-2-(4-fluorophenyl)-2-(4-…
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) | 3.07 | 8.01 | -44.37 | 2 | 4 | 1 | 37 | 362.494 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.07 | 5.63 | -8.98 | 1 | 4 | 0 | 36 | 361.486 | 5 | ↓ |