In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
April 20th, 2010 | 19 | Yes |
Popular Name: (3S)-1-[(5-bromo-2-thienyl)sulfonyl]-N,N-diethyl-pyrrolidin-3-amine (3S)-1-[(5-bromo-2-thienyl)sulfo…
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) | 3.03 | 5.48 | -42.74 | 1 | 4 | 1 | 42 | 368.342 | 5 | ↓ |
Hi High (pH 8-9.5) | 3.03 | 3.32 | -6.49 | 0 | 4 | 0 | 41 | 367.334 | 5 | ↓ |