In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 20th, 2008 | 24 | Yes |
Popular Name: (2S)-2-(4-benzylpiperazin-1-yl)-N-(2-thienylmethyl)propanamide (2S)-2-(4-benzylpiperazin-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) | 2.37 | 7.58 | -38.67 | 2 | 4 | 1 | 37 | 344.504 | 6 | ↓ |
Hi High (pH 8-9.5) | 2.37 | 5.36 | -8.36 | 1 | 4 | 0 | 36 | 343.496 | 6 | ↓ |