In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 10th, 2010 | 21 | No |
Popular Name: (3S)-N'-hydroxy-3-isoindolin-2-yl-3-phenyl-propanamidine (3S)-N'-hydroxy-3-isoindolin-2-y…
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) | 2.20 | 4.7 | -7.67 | 3 | 4 | 0 | 62 | 281.359 | 4 | ↓ |
Mid Mid (pH 6-8) | 2.20 | 7.42 | -41.79 | 4 | 4 | 1 | 63 | 282.367 | 4 | ↓ |
No pre-computed analogs available. Try a structural similarity search.