In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 16 | No |
Popular Name: (2S)-3-(4-ethylpiperazin-1-yl)-N'-hydroxy-2-methyl-3-oxo-propanamidine (2S)-3-(4-ethylpiperazin-1-yl)-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) | -0.31 | -0.96 | -12.18 | 3 | 6 | 0 | 82 | 228.296 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.31 | 1.26 | -51.91 | 4 | 6 | 1 | 83 | 229.304 | 3 | ↓ |