In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 29th, 2010 | 17 | No |
Popular Name: (2S)-3-[(5-bromo-2-thienyl)methyl-ethyl-amino]-N'-hydroxy-2-methyl-propanamidine (2S)-3-[(5-bromo-2-thienyl)methy…
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) | 2.71 | 5.07 | -44.74 | 4 | 4 | 1 | 63 | 321.264 | 6 | ↓ |
Mid Mid (pH 6-8) | 2.71 | 3.16 | -6.12 | 3 | 4 | 0 | 62 | 320.256 | 6 | ↓ |