In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 15th, 2007 | 29 | Yes |
Popular Name: N-(3-acetylphenyl)-2-(aminoBLAHyl)sulfanyl-propanamide N-(3-acetylphenyl)-2-(aminoBLAHy…
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) | 4.60 | -3.62 | -24.42 | 3 | 6 | 0 | 97 | 426.567 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.60 | -3.47 | -35.04 | 4 | 6 | 1 | 99 | 427.575 | 5 | ↓ |
Lo Low (pH 4.5-6) | 4.60 | -3.54 | -47.42 | 4 | 6 | 1 | 99 | 427.575 | 5 | ↓ |