In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 18th, 2009 | 16 | No |
Popular Name: (2R)-N'-hydroxy-2-methyl-3-(4-propylpiperazin-1-yl)propanamidine (2R)-N'-hydroxy-2-methyl-3-(4-pr…
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) | 0.88 | 1.8 | -37.59 | 4 | 5 | 1 | 66 | 229.348 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.88 | -0.47 | -5.84 | 3 | 5 | 0 | 65 | 228.34 | 5 | ↓ |
Hi High (pH 8-9.5) | 0.88 | -0.21 | -4.72 | 3 | 5 | 0 | 65 | 228.34 | 5 | ↓ |
Mid Mid (pH 6-8) | 0.88 | 1.73 | -39.89 | 4 | 5 | 1 | 66 | 229.348 | 5 | ↓ |