In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 17th, 2009 | 12 | Yes |
Popular Name: (1S)-1-(5-chloro-2-thienyl)-N,N-dimethyl-ethane-1,2-diamine (1S)-1-(5-chloro-2-thienyl)-N,N-…
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) | 1.43 | 1.66 | -45.33 | 3 | 2 | 1 | 31 | 205.734 | 3 | ↓ |
Hi High (pH 8-9.5) | 1.43 | 1.28 | -1.7 | 2 | 2 | 0 | 29 | 204.726 | 3 | ↓ |