In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
May 14th, 2010 | 16 | Yes |
Popular Name: (3S)-3-[4-(aminomethyl)-2-chloro-phenoxy]tetrahydrofuran-2-one (3S)-3-[4-(aminomethyl)-2-chloro…
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) | 0.62 | 3.68 | -52.88 | 3 | 4 | 1 | 63 | 242.682 | 3 | ↓ |
Hi High (pH 8-9.5) | 0.62 | 3.28 | -10.26 | 2 | 4 | 0 | 62 | 241.674 | 3 | ↓ |