Zinc15 property exports

Tier 1

Level 1 - mwt

A < 200 < B < 250 < C < 300 < D < 325 < E < 350 < F < 375 < G < 400 < H < 425 < I < 450 < J < 500 < K < 999

Level 2 - logP

A < -1 < B < 0 < C < 1 < D < 2 < E < 2.5 < F < 3 < G < 3.5 < H < 4 < I < 4.5 < J < 5 < K

Tier 2

Level 3 - ph_mod_fk

# 0 = ref, gs, ph 7.4 ;  1 = mid, gs, additional, ph 7 - 8
# 2 = lo, gs, ph 6.4 ish ; 3 = hi, gs, ph 8.4 ish ; 4 = hei;  5 = covalent

Level 4 - clean

A = Unknown, B = Clean, C= weak nucleophile, D = weak eletrophile, E = hot

NB currently only A in use.

Level 5 - best purch

A = premier (50), B = in-stock (40), C = agent (30), D = on-demand (20), E = boutique (10), F = not for sale

Level 6 - charge

# A <= -2 ; B = -1 ; C = 0 ; D = +1 ; E = >= 2

Examples

Lead-like:   [ABCDE][ABCDEFG]/[01][*][ABCD]
Frag-like:    [AB][ABCDEFG]/[01][*][ABCD]