In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
November 22nd, 2009 | 21 | Yes |
Popular Name: (2R)-N1-[(4S)-6,8-dichlorochroman-4-yl]-N2,N2,3-trimethyl-butane-1,2-diamine (2R)-N1-[(4S)-6,8-dichlorochroma…
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) | 3.32 | 6.95 | -43.27 | 2 | 3 | 1 | 29 | 332.295 | 5 | ↓ |
Mid Mid (pH 6-8) | 3.32 | 9.24 | -37.67 | 2 | 3 | 1 | 26 | 332.295 | 5 | ↓ |
Lo Low (pH 4.5-6) | 3.32 | 9.5 | -126.52 | 3 | 3 | 2 | 30 | 333.303 | 5 | ↓ |