In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
July 23rd, 2010 | 17 | No |
Popular Name: (2S)-N'-hydroxy-3-(4-isopropylpiperazin-1-yl)-2-methyl-3-oxo-propanamidine (2S)-N'-hydroxy-3-(4-isopropylpi…
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) | -0.01 | -0.37 | -12.13 | 3 | 6 | 0 | 82 | 242.323 | 3 | ↓ |
Mid Mid (pH 6-8) | -0.01 | 1.77 | -49.68 | 4 | 6 | 1 | 83 | 243.331 | 3 | ↓ |